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

Systemtic Name: N-(3-chlorophenyl)-3-[(4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanamide Openeye Name: N-(3-chlorophenyl)-3-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]propanamide CAS Name: N-(3-chlorophenyl)-3-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)thio]propanamide IUPAC Name: N-(3-chlorophenyl)-3-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]propanamide Traditional Name: N-(3-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(=CC(=C1)Cl)NC(=O)CCSC2=NC(=CC(=O)N2)O

Isomeric SMILES

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

InChI

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