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

Systemtic Name: 6-[2-[(3-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-5-cyano-4-(2-ethoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide Openeye Name: 6-[2-(3-chloro-4-methyl-anilino)-2-oxo-ethyl]sulfanyl-5-cyano-4-(2-ethoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide CAS Name: 6-[[2-(3-chloro-4-methylanilino)-2-oxoethyl]thio]-5-cyano-4-(2-ethoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide IUPAC Name: 6-[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl-5-cyano-4-(2-ethoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide Traditional Name: 6-[[2-(3-chloro-4-methyl-anilino)-2-keto-ethyl]thio]-5-cyano-2-methyl-4-o-phenetyl-N-phenyl-1,4-dihydropyridine-3-carboxamide Formula: C31H29ClN4O3S MolecularWeight: 573.10496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2C(=C(NC(=C2C(=O)NC3=CC=CC=C3)C)SCC(=O)NC4=CC(=C(C=C4)C)Cl)C#N

Isomeric SMILES

CCOC1=CC=CC=C1C2C(=C(NC(=C2C(=O)NC3=CC=CC=C3)C)SCC(=O)NC4=CC(=C(C=C4)C)Cl)C#N

InChI

InChI=1S/C31H29ClN4O3S/c1-4-39-26-13-9-8-12-23(26)29-24(17-33)31(40-18-27(37)35-22-15-14-19(2)25(32)16-22)34-20(3)28(29)30(38)36-21-10-6-5-7-11-21/h5-16,29,34H,4,18H2,1-3H3,(H,35,37)(H,36,38)