N-(4-chlorophenyl)-5-cyano-2-methyl-6-(phenylmethylsulfanyl)-4-pyridin-4-yl-1,4-dihydropyridine-3-carboxamide

Systemtic Name: N-(4-chlorophenyl)-5-cyano-2-methyl-6-(phenylmethylsulfanyl)-4-pyridin-4-yl-1,4-dihydropyridine-3-carboxamide Openeye Name: 6-benzylsulfanyl-N-(4-chlorophenyl)-5-cyano-2-methyl-4-(4-pyridyl)-1,4-dihydropyridine-3-carboxamide CAS Name: N-(4-chlorophenyl)-5-cyano-2-methyl-6-(phenylmethylthio)-4-pyridin-4-yl-1,4-dihydropyridine-3-carboxamide IUPAC Name: 6-benzylsulfanyl-N-(4-chlorophenyl)-5-cyano-2-methyl-4-pyridin-4-yl-1,4-dihydropyridine-3-carboxamide Traditional Name: 6-(benzylthio)-N-(4-chlorophenyl)-5-cyano-2-methyl-4-(4-pyridyl)-1,4-dihydropyridine-3-carboxamide Formula: C26H21ClN4OS MolecularWeight: 472.98914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC2=CC=CC=C2)C#N)C3=CC=NC=C3)C(=O)NC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(C(C(=C(N1)SCC2=CC=CC=C2)C#N)C3=CC=NC=C3)C(=O)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H21ClN4OS/c1-17-23(25(32)31-21-9-7-20(27)8-10-21)24(19-11-13-29-14-12-19)22(15-28)26(30-17)33-16-18-5-3-2-4-6-18/h2-14,24,30H,16H2,1H3,(H,31,32)