5-[(3-methoxyphenyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one

Systemtic Name: 5-[(3-methoxyphenyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one Openeye Name: 5-[(3-methoxyphenyl)methyl]-2-thioxo-1H-pyrimidin-4-one CAS Name: 5-[(3-methoxyphenyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one IUPAC Name: 5-[(3-methoxyphenyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one Traditional Name: 5-m-anisyl-2-thioxo-1H-pyrimidin-4-one Formula: C12H12N2O2S MolecularWeight: 248.30088

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CC2=CNC(=S)NC2=O

Isomeric SMILES

COC1=CC=CC(=C1)CC2=CNC(=S)NC2=O

InChI

InChI=1S/C12H12N2O2S/c1-16-10-4-2-3-8(6-10)5-9-7-13-12(17)14-11(9)15/h2-4,6-7H,5H2,1H3,(H2,13,14,15,17)