5-ethanoyl-4-(furan-2-yl)-6-methyl-2-(2-oxidanylidenepropylsulfanyl)-3,4-dihydropyridine-3-carbonitrile

Systemtic Name: 5-ethanoyl-4-(furan-2-yl)-6-methyl-2-(2-oxidanylidenepropylsulfanyl)-3,4-dihydropyridine-3-carbonitrile Openeye Name: 2-acetonylsulfanyl-5-acetyl-4-(2-furyl)-6-methyl-3,4-dihydropyridine-3-carbonitrile CAS Name: 5-acetyl-4-(2-furanyl)-6-methyl-2-(2-oxopropylthio)-3,4-dihydropyridine-3-carbonitrile IUPAC Name: 5-acetyl-4-(furan-2-yl)-6-methyl-2-(2-oxopropylsulfanyl)-3,4-dihydropyridine-3-carbonitrile Traditional Name: 2-(acetonylthio)-5-acetyl-4-(2-furyl)-6-methyl-3,4-dihydropyridine-3-carbonitrile Formula: C16H16N2O3S MolecularWeight: 316.37484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(C(=N1)SCC(=O)C)C#N)C2=CC=CO2)C(=O)C

Isomeric SMILES

CC1=C(C(C(C(=N1)SCC(=O)C)C#N)C2=CC=CO2)C(=O)C

InChI

InChI=1S/C16H16N2O3S/c1-9(19)8-22-16-12(7-17)15(13-5-4-6-21-13)14(11(3)20)10(2)18-16/h4-6,12,15H,8H2,1-3H3