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

Systemtic Name: N-(2-cyanophenyl)-2-[(4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanamide Openeye Name: N-(2-cyanophenyl)-2-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide CAS Name: N-(2-cyanophenyl)-2-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)thio]acetamide IUPAC Name: N-(2-cyanophenyl)-2-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide Traditional Name: N-(2-cyanophenyl)-2-[(4-hydroxy-6-keto-1H-pyrimidin-2-yl)thio]acetamide Formula: C13H10N4O3S MolecularWeight: 302.3085

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)NC(=O)CSC2=NC(=CC(=O)N2)O

Isomeric SMILES

C1=CC=C(C(=C1)C#N)NC(=O)CSC2=NC(=CC(=O)N2)O

InChI

InChI=1S/C13H10N4O3S/c14-6-8-3-1-2-4-9(8)15-12(20)7-21-13-16-10(18)5-11(19)17-13/h1-5H,7H2,(H,15,20)(H2,16,17,18,19)