N-(2-cyanophenyl)-2-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]butanamide

Systemtic Name: N-(2-cyanophenyl)-2-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]butanamide Openeye Name: N-(2-cyanophenyl)-2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]butanamide CAS Name: N-(2-cyanophenyl)-2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]butanamide IUPAC Name: N-(2-cyanophenyl)-2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]butanamide Traditional Name: N-(2-cyanophenyl)-2-[(4-keto-6-methyl-1H-pyrimidin-2-yl)thio]butyramide Formula: C16H16N4O2S MolecularWeight: 328.38884

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1C#N)SC2=NC(=O)C=C(N2)C

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1C#N)SC2=NC(=O)C=C(N2)C

InChI

InChI=1S/C16H16N4O2S/c1-3-13(23-16-18-10(2)8-14(21)20-16)15(22)19-12-7-5-4-6-11(12)9-17/h4-8,13H,3H2,1-2H3,(H,19,22)(H,18,20,21)