propan-2-yl 4-cyano-3-methyl-5-[(2-phenyl-2-phenylsulfanyl-ethanoyl)amino]thiophene-2-carboxylate

Systemtic Name: propan-2-yl 4-cyano-3-methyl-5-[(2-phenyl-2-phenylsulfanyl-ethanoyl)amino]thiophene-2-carboxylate Openeye Name: isopropyl 4-cyano-3-methyl-5-[(2-phenyl-2-phenylsulfanyl-acetyl)amino]thiophene-2-carboxylate CAS Name: 4-cyano-3-methyl-5-[[1-oxo-2-phenyl-2-(phenylthio)ethyl]amino]-2-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-cyano-3-methyl-5-[(2-phenyl-2-phenylsulfanylacetyl)amino]thiophene-2-carboxylate Traditional Name: 4-cyano-3-methyl-5-[[2-phenyl-2-(phenylthio)acetyl]amino]thiophene-2-carboxylic acid isopropyl ester Formula: C24H22N2O3S2 MolecularWeight: 450.57308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C(C2=CC=CC=C2)SC3=CC=CC=C3)C(=O)OC(C)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C(C2=CC=CC=C2)SC3=CC=CC=C3)C(=O)OC(C)C

InChI

InChI=1S/C24H22N2O3S2/c1-15(2)29-24(28)20-16(3)19(14-25)23(31-20)26-22(27)21(17-10-6-4-7-11-17)30-18-12-8-5-9-13-18/h4-13,15,21H,1-3H3,(H,26,27)