ethyl 2-[2-(4-propan-2-ylsulfanylphenyl)ethanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(4-propan-2-ylsulfanylphenyl)ethanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(4-isopropylsulfanylphenyl)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[1-oxo-2-[4-(propan-2-ylthio)phenyl]ethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(4-propan-2-ylsulfanylphenyl)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[[2-[4-(isopropylthio)phenyl]acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid ethyl ester Formula: C21H25NO3S2 MolecularWeight: 403.5581

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)CC3=CC=C(C=C3)SC(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)CC3=CC=C(C=C3)SC(C)C

InChI

InChI=1S/C21H25NO3S2/c1-4-25-21(24)19-16-6-5-7-17(16)27-20(19)22-18(23)12-14-8-10-15(11-9-14)26-13(2)3/h8-11,13H,4-7,12H2,1-3H3,(H,22,23)