5-cyano-6-[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-2-methyl-N-(2-methylphenyl)-4-phenyl-1,4-dihydropyridine-3-carboxamide

Systemtic Name: 5-cyano-6-[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-2-methyl-N-(2-methylphenyl)-4-phenyl-1,4-dihydropyridine-3-carboxamide Openeye Name: 5-cyano-6-[2-(2,3-dimethylanilino)-2-oxo-ethyl]sulfanyl-2-methyl-N-(o-tolyl)-4-phenyl-1,4-dihydropyridine-3-carboxamide CAS Name: 5-cyano-6-[[2-(2,3-dimethylanilino)-2-oxoethyl]thio]-2-methyl-N-(2-methylphenyl)-4-phenyl-1,4-dihydropyridine-3-carboxamide IUPAC Name: 5-cyano-6-[2-(2,3-dimethylanilino)-2-oxoethyl]sulfanyl-2-methyl-N-(2-methylphenyl)-4-phenyl-1,4-dihydropyridine-3-carboxamide Traditional Name: 5-cyano-6-[[2-(2,3-dimethylanilino)-2-keto-ethyl]thio]-2-methyl-N-(o-tolyl)-4-phenyl-1,4-dihydropyridine-3-carboxamide Formula: C31H30N4O2S MolecularWeight: 522.6605

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=CC=C3C)C4=CC=CC=C4)C#N)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=CC=C3C)C4=CC=CC=C4)C#N)C

InChI

InChI=1S/C31H30N4O2S/c1-19-12-10-16-26(21(19)3)34-27(36)18-38-31-24(17-32)29(23-13-6-5-7-14-23)28(22(4)33-31)30(37)35-25-15-9-8-11-20(25)2/h5-16,29,33H,18H2,1-4H3,(H,34,36)(H,35,37)