(4R)-5-ethanoyl-6-methyl-2-prop-2-enylsulfanyl-4-pyridin-3-yl-1,4-dihydropyridine-3-carbonitrile

Systemtic Name: (4R)-5-ethanoyl-6-methyl-2-prop-2-enylsulfanyl-4-pyridin-3-yl-1,4-dihydropyridine-3-carbonitrile Openeye Name: (4R)-5-acetyl-2-allylsulfanyl-6-methyl-4-(3-pyridyl)-1,4-dihydropyridine-3-carbonitrile CAS Name: (4R)-5-acetyl-6-methyl-2-(prop-2-enylthio)-4-(3-pyridinyl)-1,4-dihydropyridine-3-carbonitrile IUPAC Name: (4R)-5-acetyl-6-methyl-2-prop-2-enylsulfanyl-4-pyridin-3-yl-1,4-dihydropyridine-3-carbonitrile Traditional Name: (4R)-5-acetyl-2-(allylthio)-6-methyl-4-(3-pyridyl)-1,4-dihydropyridine-3-carbonitrile Formula: C17H17N3OS MolecularWeight: 311.40138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC=C)C#N)C2=CN=CC=C2)C(=O)C

Isomeric SMILES

CC1=C([C@H](C(=C(N1)SCC=C)C#N)C2=CN=CC=C2)C(=O)C

InChI

InChI=1S/C17H17N3OS/c1-4-8-22-17-14(9-18)16(13-6-5-7-19-10-13)15(12(3)21)11(2)20-17/h4-7,10,16,20H,1,8H2,2-3H3/t16-/m0/s1