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

Systemtic Name: N-(4-acetamidophenyl)-3-[(4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanamide Openeye Name: N-(4-acetamidophenyl)-3-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]propanamide CAS Name: N-(4-acetamidophenyl)-3-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)thio]propanamide IUPAC Name: N-(4-acetamidophenyl)-3-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]propanamide Traditional Name: N-(4-acetamidophenyl)-3-[(4-hydroxy-6-keto-1H-pyrimidin-2-yl)thio]propionamide Formula: C15H16N4O4S MolecularWeight: 348.37694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)CCSC2=NC(=CC(=O)N2)O

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)CCSC2=NC(=CC(=O)N2)O

InChI

InChI=1S/C15H16N4O4S/c1-9(20)16-10-2-4-11(5-3-10)17-12(21)6-7-24-15-18-13(22)8-14(23)19-15/h2-5,8H,6-7H2,1H3,(H,16,20)(H,17,21)(H2,18,19,22,23)