(4R)-3-cyano-4-(2-ethoxyphenyl)-6-methyl-N-phenyl-2-(phenylmethylsulfanyl)-3,4-dihydropyridine-5-carboxamide

Systemtic Name: (4R)-3-cyano-4-(2-ethoxyphenyl)-6-methyl-N-phenyl-2-(phenylmethylsulfanyl)-3,4-dihydropyridine-5-carboxamide Openeye Name: (4R)-2-benzylsulfanyl-3-cyano-4-(2-ethoxyphenyl)-6-methyl-N-phenyl-3,4-dihydropyridine-5-carboxamide CAS Name: (4R)-3-cyano-4-(2-ethoxyphenyl)-6-methyl-N-phenyl-2-(phenylmethylthio)-3,4-dihydropyridine-5-carboxamide IUPAC Name: (4R)-2-benzylsulfanyl-3-cyano-4-(2-ethoxyphenyl)-6-methyl-N-phenyl-3,4-dihydropyridine-5-carboxamide Traditional Name: (4R)-2-(benzylthio)-3-cyano-6-methyl-4-o-phenetyl-N-phenyl-3,4-dihydropyridine-5-carboxamide Formula: C29H27N3O2S MolecularWeight: 481.60858

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2C(C(=NC(=C2C(=O)NC3=CC=CC=C3)C)SCC4=CC=CC=C4)C#N

Isomeric SMILES

CCOC1=CC=CC=C1[C@H]2C(C(=NC(=C2C(=O)NC3=CC=CC=C3)C)SCC4=CC=CC=C4)C#N

InChI

InChI=1S/C29H27N3O2S/c1-3-34-25-17-11-10-16-23(25)27-24(18-30)29(35-19-21-12-6-4-7-13-21)31-20(2)26(27)28(33)32-22-14-8-5-9-15-22/h4-17,24,27H,3,19H2,1-2H3,(H,32,33)/t24?,27-/m0/s1