(4R)-5-ethanoyl-6-methyl-2-(3-methylbut-2-enylsulfanyl)-4-(3-methylphenyl)-3,4-dihydropyridine-3-carbonitrile

Systemtic Name: (4R)-5-ethanoyl-6-methyl-2-(3-methylbut-2-enylsulfanyl)-4-(3-methylphenyl)-3,4-dihydropyridine-3-carbonitrile Openeye Name: (4R)-5-acetyl-6-methyl-2-(3-methylbut-2-enylsulfanyl)-4-(m-tolyl)-3,4-dihydropyridine-3-carbonitrile CAS Name: (4R)-5-acetyl-6-methyl-2-(3-methylbut-2-enylthio)-4-(3-methylphenyl)-3,4-dihydropyridine-3-carbonitrile IUPAC Name: (4R)-5-acetyl-6-methyl-2-(3-methylbut-2-enylsulfanyl)-4-(3-methylphenyl)-3,4-dihydropyridine-3-carbonitrile Traditional Name: (4R)-5-acetyl-6-methyl-2-(3-methylbut-2-enylthio)-4-(m-tolyl)-3,4-dihydropyridine-3-carbonitrile Formula: C21H24N2OS MolecularWeight: 352.49306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2C(C(=NC(=C2C(=O)C)C)SCC=C(C)C)C#N

Isomeric SMILES

CC1=CC=CC(=C1)[C@H]2C(C(=NC(=C2C(=O)C)C)SCC=C(C)C)C#N

InChI

InChI=1S/C21H24N2OS/c1-13(2)9-10-25-21-18(12-22)20(17-8-6-7-14(3)11-17)19(16(5)24)15(4)23-21/h6-9,11,18,20H,10H2,1-5H3/t18?,20-/m0/s1