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

Systemtic Name: N-(4-chlorophenyl)-5-cyano-2-methyl-6-prop-2-enylsulfanyl-4-pyridin-4-yl-1,4-dihydropyridine-3-carboxamide Openeye Name: 6-allylsulfanyl-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-(prop-2-enylthio)-4-pyridin-4-yl-1,4-dihydropyridine-3-carboxamide IUPAC Name: N-(4-chlorophenyl)-5-cyano-2-methyl-6-prop-2-enylsulfanyl-4-pyridin-4-yl-1,4-dihydropyridine-3-carboxamide Traditional Name: 6-(allylthio)-N-(4-chlorophenyl)-5-cyano-2-methyl-4-(4-pyridyl)-1,4-dihydropyridine-3-carboxamide Formula: C22H19ClN4OS MolecularWeight: 422.93046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC=C)C#N)C2=CC=NC=C2)C(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C(C(=C(N1)SCC=C)C#N)C2=CC=NC=C2)C(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H19ClN4OS/c1-3-12-29-22-18(13-24)20(15-8-10-25-11-9-15)19(14(2)26-22)21(28)27-17-6-4-16(23)5-7-17/h3-11,20,26H,1,12H2,2H3,(H,27,28)