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

Systemtic Name: 5-cyano-4-(furan-2-yl)-2-methyl-N-(2-methylphenyl)-6-(phenylmethylsulfanyl)-1,4-dihydropyridine-3-carboxamide Openeye Name: 6-benzylsulfanyl-5-cyano-4-(2-furyl)-2-methyl-N-(o-tolyl)-1,4-dihydropyridine-3-carboxamide CAS Name: 5-cyano-4-(2-furanyl)-2-methyl-N-(2-methylphenyl)-6-(phenylmethylthio)-1,4-dihydropyridine-3-carboxamide IUPAC Name: 6-benzylsulfanyl-5-cyano-4-(furan-2-yl)-2-methyl-N-(2-methylphenyl)-1,4-dihydropyridine-3-carboxamide Traditional Name: 6-(benzylthio)-5-cyano-4-(2-furyl)-2-methyl-N-(o-tolyl)-1,4-dihydropyridine-3-carboxamide Formula: C26H23N3O2S MolecularWeight: 441.54472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=C(NC(=C(C2C3=CC=CO3)C#N)SCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=C(NC(=C(C2C3=CC=CO3)C#N)SCC4=CC=CC=C4)C

InChI

InChI=1S/C26H23N3O2S/c1-17-9-6-7-12-21(17)29-25(30)23-18(2)28-26(32-16-19-10-4-3-5-11-19)20(15-27)24(23)22-13-8-14-31-22/h3-14,24,28H,16H2,1-2H3,(H,29,30)