5-ethanoyl-3-(3-methoxyphenyl)-2-sulfanylidene-1H-pyrimidin-4-one

Systemtic Name: 5-ethanoyl-3-(3-methoxyphenyl)-2-sulfanylidene-1H-pyrimidin-4-one Openeye Name: 5-acetyl-3-(3-methoxyphenyl)-2-thioxo-1H-pyrimidin-4-one CAS Name: 5-acetyl-3-(3-methoxyphenyl)-2-sulfanylidene-1H-pyrimidin-4-one IUPAC Name: 5-acetyl-3-(3-methoxyphenyl)-2-sulfanylidene-1H-pyrimidin-4-one Traditional Name: 5-acetyl-3-(3-methoxyphenyl)-2-thioxo-1H-pyrimidin-4-one Formula: C13H12N2O3S MolecularWeight: 276.31098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CNC(=S)N(C1=O)C2=CC(=CC=C2)OC

Isomeric SMILES

CC(=O)C1=CNC(=S)N(C1=O)C2=CC(=CC=C2)OC

InChI

InChI=1S/C13H12N2O3S/c1-8(16)11-7-14-13(19)15(12(11)17)9-4-3-5-10(6-9)18-2/h3-7H,1-2H3,(H,14,19)