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

Systemtic Name: 5-cyano-6-[2-[(4-ethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-(3-methoxy-4-oxidanyl-phenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide Openeye Name: 5-cyano-6-[2-(4-ethylanilino)-2-oxo-ethyl]sulfanyl-4-(4-hydroxy-3-methoxy-phenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide CAS Name: 5-cyano-6-[[2-(4-ethylanilino)-2-oxoethyl]thio]-4-(4-hydroxy-3-methoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide IUPAC Name: 5-cyano-6-[2-(4-ethylanilino)-2-oxoethyl]sulfanyl-4-(4-hydroxy-3-methoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide Traditional Name: 5-cyano-6-[[2-(4-ethylanilino)-2-keto-ethyl]thio]-4-(4-hydroxy-3-methoxy-phenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide Formula: C31H30N4O4S MolecularWeight: 554.6593

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=CC=C3)C4=CC(=C(C=C4)O)OC)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=CC=C3)C4=CC(=C(C=C4)O)OC)C#N

InChI

InChI=1S/C31H30N4O4S/c1-4-20-10-13-23(14-11-20)34-27(37)18-40-31-24(17-32)29(21-12-15-25(36)26(16-21)39-3)28(19(2)33-31)30(38)35-22-8-6-5-7-9-22/h5-16,29,33,36H,4,18H2,1-3H3,(H,34,37)(H,35,38)