5-cyano-4-(4-methoxyphenyl)-2-methyl-N-phenyl-6-sulfanyl-3,4-dihydropyridine-3-carboxamide

Systemtic Name: 5-cyano-4-(4-methoxyphenyl)-2-methyl-N-phenyl-6-sulfanyl-3,4-dihydropyridine-3-carboxamide Openeye Name: 5-cyano-4-(4-methoxyphenyl)-2-methyl-N-phenyl-6-sulfanyl-3,4-dihydropyridine-3-carboxamide CAS Name: 5-cyano-6-mercapto-4-(4-methoxyphenyl)-2-methyl-N-phenyl-3,4-dihydropyridine-3-carboxamide IUPAC Name: 5-cyano-4-(4-methoxyphenyl)-2-methyl-N-phenyl-6-sulfanyl-3,4-dihydropyridine-3-carboxamide Traditional Name: 5-cyano-6-mercapto-4-(4-methoxyphenyl)-2-methyl-N-phenyl-3,4-dihydropyridine-3-carboxamide Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)NC2=CC=CC=C2)C3=CC=C(C=C3)OC)C#N)S

Isomeric SMILES

CC1=NC(=C(C(C1C(=O)NC2=CC=CC=C2)C3=CC=C(C=C3)OC)C#N)S

InChI

InChI=1S/C21H19N3O2S/c1-13-18(20(25)24-15-6-4-3-5-7-15)19(17(12-22)21(27)23-13)14-8-10-16(26-2)11-9-14/h3-11,18-19,27H,1-2H3,(H,24,25)