(4R)-3-ethanoyl-2-methyl-4-(2-methylpropyl)-6-methylsulfanyl-3,4-dihydropyridine-5-carbonitrile

Systemtic Name: (4R)-3-ethanoyl-2-methyl-4-(2-methylpropyl)-6-methylsulfanyl-3,4-dihydropyridine-5-carbonitrile Openeye Name: (4R)-3-acetyl-4-isobutyl-2-methyl-6-methylsulfanyl-3,4-dihydropyridine-5-carbonitrile CAS Name: (4R)-3-acetyl-2-methyl-4-(2-methylpropyl)-6-(methylthio)-3,4-dihydropyridine-5-carbonitrile IUPAC Name: (4R)-3-acetyl-2-methyl-4-(2-methylpropyl)-6-methylsulfanyl-3,4-dihydropyridine-5-carbonitrile Traditional Name: (4R)-3-acetyl-4-isobutyl-2-methyl-6-(methylthio)-3,4-dihydropyridine-5-carbonitrile Formula: C14H20N2OS MolecularWeight: 264.3864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)C)CC(C)C)C#N)SC

Isomeric SMILES

CC1=NC(=C([C@@H](C1C(=O)C)CC(C)C)C#N)SC

InChI

InChI=1S/C14H20N2OS/c1-8(2)6-11-12(7-15)14(18-5)16-9(3)13(11)10(4)17/h8,11,13H,6H2,1-5H3/t11-,13?/m0/s1