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

Systemtic Name: 5-cyano-2-methyl-N-phenyl-6-(phenylmethylsulfanyl)-4-pyridin-3-yl-1,4-dihydropyridine-3-carboxamide Openeye Name: 6-benzylsulfanyl-5-cyano-2-methyl-N-phenyl-4-(3-pyridyl)-1,4-dihydropyridine-3-carboxamide CAS Name: 5-cyano-2-methyl-N-phenyl-6-(phenylmethylthio)-4-(3-pyridinyl)-1,4-dihydropyridine-3-carboxamide IUPAC Name: 6-benzylsulfanyl-5-cyano-2-methyl-N-phenyl-4-pyridin-3-yl-1,4-dihydropyridine-3-carboxamide Traditional Name: 6-(benzylthio)-5-cyano-2-methyl-N-phenyl-4-(3-pyridyl)-1,4-dihydropyridine-3-carboxamide Formula: C26H22N4OS MolecularWeight: 438.54408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H22N4OS/c1-18-23(25(31)30-21-12-6-3-7-13-21)24(20-11-8-14-28-16-20)22(15-27)26(29-18)32-17-19-9-4-2-5-10-19/h2-14,16,24,29H,17H2,1H3,(H,30,31)