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Murcko scaffold

Ring system with 3 rings and 17 atoms

39 chemicals on CompoundList share this ring system.

Rings: 3
Scaffold atoms: 17
Chemicals: 39
With full pages: 5

Scaffold SMILES

O=S1(=O)Nc2ccccc2Cc2ccccc21

A Bemis-Murcko scaffold is what remains of a molecule when every side chain is removed: the rings and the chains that link them. Chemicals that share a scaffold often belong to the same compound series, which helps when you look for analogues, alternative suppliers or related building blocks.

Substructure search with this scaffold

Murcko scaffold O=S1(=O)Nc2ccccc2Cc2ccccc21

Computed from the structures of the chemicals listed here. Stereo and charges are removed before the scaffold is taken.

Chemicals with this scaffold

Open one to see its structure, properties and suppliers.

Showing 1 to 39 of 39 chemicals

Tianeptine chemical structure, C21H25ClN2O4S, CAS 72797-41-2

CAS 72797-41-2C₂₁H₂₅ClN₂O₄S

Dibenzo(c,f)(1,2)thiazepin-11-ol, 6,11-dihydro-6-methyl-, 5,5-dioxide chemical structure, C14H13NO3S, CAS 26638-56-2

Dibenzo(c,f)(1,2)thiazepin-11-ol, 6,11-dihydro-6-methyl-, 5,5-dioxide

CAS 26638-56-2C₁₄H₁₃NO₃S

Dibenzo(c,f)(1,2)thiazepine, 6,11-dihydro-11-methoxy-6-methyl-, 5,5-dioxide chemical structure, C15H15NO3S, CAS 155444-01-2

Dibenzo(c,f)(1,2)thiazepine, 6,11-dihydro-11-methoxy-6-methyl-, 5,5-dioxide

CAS 155444-01-2C₁₅H₁₅NO₃S

Dibenzo(c,f)(1,2)thiazepine, 6,11-dihydro-11-ethoxy-6-methyl-, 5,5-dioxide chemical structure, C16H17NO3S, CAS 155444-02-3

Dibenzo(c,f)(1,2)thiazepine, 6,11-dihydro-11-ethoxy-6-methyl-, 5,5-dioxide

CAS 155444-02-3C₁₆H₁₇NO₃S

Dibenzo(c,f)(1,2)thiazepine, 6,11-dihydro-6-methyl-11-propoxy-, 5,5-dioxide chemical structure, C17H19NO3S, CAS 155444-03-4

Dibenzo(c,f)(1,2)thiazepine, 6,11-dihydro-6-methyl-11-propoxy-, 5,5-dioxide

CAS 155444-03-4C₁₇H₁₉NO₃S

Dibenzo(c,f)(1,2)thiazepine, 6,11-dihydro-6-methyl-11-(1-methylethoxy)-, 5,5-dioxide chemical structure, C17H19NO3S, CAS 155444-04-5

Dibenzo(c,f)(1,2)thiazepine, 6,11-dihydro-6-methyl-11-(1-methylethoxy)-, 5,5-dioxide

CAS 155444-04-5C₁₇H₁₉NO₃S

Ethanamine, 2-((6,11-dihydro-6-methyldibenzo(c,f)thiazepin-11-yl)oxy)-N,N-dimethyl-, 5,5-dioxide, (Z)-2-butenedioate (1:1) chemical structure, C22H26N2O7S, CAS 28810-22-2

Ethanamine, 2-((6,11-dihydro-6-methyldibenzo(c,f)thiazepin-11-yl)oxy)-N,N-dimethyl-, 5,5-dioxide, (Z)-2-butenedioate (1:1)

CAS 28810-22-2C₂₂H₂₆N₂O₇S

Ethanamine, 2-((6,11-dihydro-6-methyldibenzo(c,f)thiazepin-11-yl)oxy)-N-methyl-, 5,5-dioxide(Z)-2-butenedioate (1:1) chemical structure, C21H24N2O7S, CAS 155444-07-8

Ethanamine, 2-((6,11-dihydro-6-methyldibenzo(c,f)thiazepin-11-yl)oxy)-N-methyl-, 5,5-dioxide(Z)-2-butenedioate (1:1)

CAS 155444-07-8C₂₁H₂₄N₂O₇S

3-Chloro-6,11-dihydro-6-methyldibenzo(c,f)(1,2)thiazepin-11-amine 5,5-dioxide chemical structure, C14H13ClN2O2S, CAS 66981-75-7

3-Chloro-6,11-dihydro-6-methyldibenzo(c,f)(1,2)thiazepin-11-amine 5,5-dioxide

CAS 66981-75-7C₁₄H₁₃ClN₂O₂S

(R)-Tianeptine chemical structure, C21H25ClN2O4S, CAS 866453-90-9

CAS 866453-90-9C₂₁H₂₅ClN₂O₄S

3,11-Dichloro-6,11-dihydro-6-methyldibenzo(c,f)(1,2)thiazepine 5,5-dioxide chemical structure, C14H11Cl2NO2S, CAS 26638-66-4

3,11-Dichloro-6,11-dihydro-6-methyldibenzo(c,f)(1,2)thiazepine 5,5-dioxide

CAS 26638-66-4C₁₄H₁₁Cl₂NO₂S

3-Chloro-6,11-dihydro-6-methyldibenzo(c,f)(1,2)thiazepin-11-ol 5,5-dioxide chemical structure, C14H12ClNO3S, CAS 26723-60-4

3-Chloro-6,11-dihydro-6-methyldibenzo(c,f)(1,2)thiazepin-11-ol 5,5-dioxide

CAS 26723-60-4C₁₄H₁₂ClNO₃S

11-Amino-3-chloro-6,11-dihydro-5,5-dioxo-6-methyl-dibenzo(c,f)(1,2)thiazepine hydrochloride chemical structure, C14H14Cl2N2O2S, CAS 363138-44-7

11-Amino-3-chloro-6,11-dihydro-5,5-dioxo-6-methyl-dibenzo(c,f)(1,2)thiazepine hydrochloride

CAS 363138-44-7C₁₄H₁₄Cl₂N₂O₂S

Tianeptine sodium chemical structure, C21H24ClN2NaO4S, CAS 30123-17-2

Tianeptine sodium

CAS 30123-17-2C₂₁H₂₄ClN₂NaO₄S

(R)-Pentanoic acid tianeptine chemical structure, C19H21ClN2O4S, CAS 1485294-22-1

(R)-Pentanoic acid tianeptine

CAS 1485294-22-1C₁₉H₂₁ClN₂O₄S

S-Pentanoic acid tianeptine chemical structure, C19H21ClN2O4S, CAS 1485294-27-6

S-Pentanoic acid tianeptine

CAS 1485294-27-6C₁₉H₂₁ClN₂O₄S

Tianeptine methyl ester chemical structure, C22H27ClN2O4S, CAS 887588-50-3

Tianeptine methyl ester

CAS 887588-50-3C₂₂H₂₇ClN₂O₄S

Heptanoic acid, 7-((3-chloro-6,11-dihydro-6-methyl-5,5-dioxidodibenzo(c,f)(1,2)thiazepin-11-yl)amino)-, ethyl ester chemical structure, C23H29ClN2O4S, CAS 66981-77-9

Heptanoic acid, 7-((3-chloro-6,11-dihydro-6-methyl-5,5-dioxidodibenzo(c,f)(1,2)thiazepin-11-yl)amino)-, ethyl ester

CAS 66981-77-9C₂₃H₂₉ClN₂O₄S

Tianeptine hemisulfate monohydrate chemical structure, C42H56Cl2N4O14S3, CAS 1224690-84-9

Tianeptine hemisulfate monohydrate

CAS 1224690-84-9C₄₂H₅₆Cl₂N₄O₁₄S₃

Decarboxy tianeptine-d12 nitrile chemical structure, C21H24ClN3O2S, CAS 1216525-46-0

Decarboxy tianeptine-d12 nitrile

CAS 1216525-46-0C₂₁H₂₄ClN₃O₂S

Tianeptine-d12 chemical structure, C21H25ClN2O4S, CAS 1189870-26-5

CAS 1189870-26-5C₂₁H₂₅ClN₂O₄S

Tianeptine metabolite MC5 sodium salt chemical structure, C19H20ClN2NaO4S, CAS 115220-11-6

Tianeptine metabolite MC5 sodium salt

CAS 115220-11-6C₁₉H₂₀ClN₂NaO₄S

Tianeptine metabolite MC5-d4 sodium salt chemical structure, C19H20ClN2NaO4S, CAS 1330171-36-2

Tianeptine metabolite MC5-d4 sodium salt

CAS 1330171-36-2C₁₉H₂₀ClN₂NaO₄S

Tianeptine metabolite MC5 methyl ester chemical structure, C20H23ClN2O4S, CAS 1159977-59-9

Tianeptine metabolite MC5 methyl ester

CAS 1159977-59-9C₂₀H₂₃ClN₂O₄S