ethyl 2-[[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]carbonylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]carbonylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: ethyl 2-[[3-(azepan-1-ylsulfonyl)-4-methyl-benzoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[[3-(1-azepanylsulfonyl)-4-methylphenyl]-oxomethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[3-(azepan-1-ylsulfonyl)-4-methylbenzoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[[3-(azepan-1-ylsulfonyl)-4-methyl-benzoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid ethyl ester Formula: C24H30N2O5S2 MolecularWeight: 490.6354

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)C3=CC(=C(C=C3)C)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)C3=CC(=C(C=C3)C)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C24H30N2O5S2/c1-3-31-24(28)21-18-9-8-10-19(18)32-23(21)25-22(27)17-12-11-16(2)20(15-17)33(29,30)26-13-6-4-5-7-14-26/h11-12,15H,3-10,13-14H2,1-2H3,(H,25,27)