2-(cyanomethylsulfanyl)-5-ethanoyl-6-methyl-4-(5-methylfuran-2-yl)-1,4-dihydropyridine-3-carbonitrile

Systemtic Name: 2-(cyanomethylsulfanyl)-5-ethanoyl-6-methyl-4-(5-methylfuran-2-yl)-1,4-dihydropyridine-3-carbonitrile Openeye Name: 5-acetyl-2-(cyanomethylsulfanyl)-6-methyl-4-(5-methyl-2-furyl)-1,4-dihydropyridine-3-carbonitrile CAS Name: 5-acetyl-2-(cyanomethylthio)-6-methyl-4-(5-methyl-2-furanyl)-1,4-dihydropyridine-3-carbonitrile IUPAC Name: 5-acetyl-2-(cyanomethylsulfanyl)-6-methyl-4-(5-methylfuran-2-yl)-1,4-dihydropyridine-3-carbonitrile Traditional Name: 5-acetyl-2-(cyanomethylthio)-6-methyl-4-(5-methyl-2-furyl)-1,4-dihydropyridine-3-carbonitrile Formula: C16H15N3O2S MolecularWeight: 313.3742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2C(=C(NC(=C2C(=O)C)C)SCC#N)C#N

Isomeric SMILES

CC1=CC=C(O1)C2C(=C(NC(=C2C(=O)C)C)SCC#N)C#N

InChI

InChI=1S/C16H15N3O2S/c1-9-4-5-13(21-9)15-12(8-18)16(22-7-6-17)19-10(2)14(15)11(3)20/h4-5,15,19H,7H2,1-3H3