N-(2-chlorophenyl)-3-[(4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanamide

Systemtic Name: N-(2-chlorophenyl)-3-[(4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanamide Openeye Name: N-(2-chlorophenyl)-3-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]propanamide CAS Name: N-(2-chlorophenyl)-3-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)thio]propanamide IUPAC Name: N-(2-chlorophenyl)-3-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]propanamide Traditional Name: N-(2-chlorophenyl)-3-[(4-hydroxy-6-keto-1H-pyrimidin-2-yl)thio]propionamide Formula: C13H12ClN3O3S MolecularWeight: 325.77068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CCSC2=NC(=CC(=O)N2)O)Cl

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CCSC2=NC(=CC(=O)N2)O)Cl

InChI

InChI=1S/C13H12ClN3O3S/c14-8-3-1-2-4-9(8)15-10(18)5-6-21-13-16-11(19)7-12(20)17-13/h1-4,7H,5-6H2,(H,15,18)(H2,16,17,19,20)