3-cyano-4-(3-fluorophenyl)-6-methyl-N-(2-methylphenyl)-2-prop-2-enylsulfanyl-1,2-dihydropyridine-5-carboxamide

Systemtic Name: 3-cyano-4-(3-fluorophenyl)-6-methyl-N-(2-methylphenyl)-2-prop-2-enylsulfanyl-1,2-dihydropyridine-5-carboxamide Openeye Name: 2-allylsulfanyl-3-cyano-4-(3-fluorophenyl)-6-methyl-N-(o-tolyl)-1,2-dihydropyridine-5-carboxamide CAS Name: 3-cyano-4-(3-fluorophenyl)-6-methyl-N-(2-methylphenyl)-2-(prop-2-enylthio)-1,2-dihydropyridine-5-carboxamide IUPAC Name: 3-cyano-4-(3-fluorophenyl)-6-methyl-N-(2-methylphenyl)-2-prop-2-enylsulfanyl-1,2-dihydropyridine-5-carboxamide Traditional Name: 2-(allylthio)-3-cyano-4-(3-fluorophenyl)-6-methyl-N-(o-tolyl)-1,2-dihydropyridine-5-carboxamide Formula: C24H22FN3OS MolecularWeight: 419.514383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=C(NC(C(=C2C3=CC(=CC=C3)F)C#N)SCC=C)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=C(NC(C(=C2C3=CC(=CC=C3)F)C#N)SCC=C)C

InChI

InChI=1S/C24H22FN3OS/c1-4-12-30-24-19(14-26)22(17-9-7-10-18(25)13-17)21(16(3)27-24)23(29)28-20-11-6-5-8-15(20)2/h4-11,13,24,27H,1,12H2,2-3H3,(H,28,29)