2-[2,4-bis(oxidanylidene)pentan-3-ylsulfanyl]-4-(4-chlorophenyl)-5-ethanoyl-6-methyl-pyridine-3-carbonitrile

Systemtic Name: 2-[2,4-bis(oxidanylidene)pentan-3-ylsulfanyl]-4-(4-chlorophenyl)-5-ethanoyl-6-methyl-pyridine-3-carbonitrile Openeye Name: 5-acetyl-2-(1-acetyl-2-oxo-propyl)sulfanyl-4-(4-chlorophenyl)-6-methyl-pyridine-3-carbonitrile CAS Name: 5-acetyl-4-(4-chlorophenyl)-2-(2,4-dioxopentan-3-ylthio)-6-methyl-3-pyridinecarbonitrile IUPAC Name: 5-acetyl-4-(4-chlorophenyl)-2-(2,4-dioxopentan-3-ylsulfanyl)-6-methylpyridine-3-carbonitrile Traditional Name: 5-acetyl-2-[(1-acetyl-2-keto-propyl)thio]-4-(4-chlorophenyl)-6-methyl-nicotinonitrile Formula: C20H17ClN2O3S MolecularWeight: 400.87858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=N1)SC(C(=O)C)C(=O)C)C#N)C2=CC=C(C=C2)Cl)C(=O)C

Isomeric SMILES

CC1=C(C(=C(C(=N1)SC(C(=O)C)C(=O)C)C#N)C2=CC=C(C=C2)Cl)C(=O)C

InChI

InChI=1S/C20H17ClN2O3S/c1-10-17(11(2)24)18(14-5-7-15(21)8-6-14)16(9-22)20(23-10)27-19(12(3)25)13(4)26/h5-8,19H,1-4H3