5-[(3,4-dimethylphenyl)methyl]-6-oxidanyl-2-sulfanylidene-1H-pyrimidin-4-one

Systemtic Name: 5-[(3,4-dimethylphenyl)methyl]-6-oxidanyl-2-sulfanylidene-1H-pyrimidin-4-one Openeye Name: 5-[(3,4-dimethylphenyl)methyl]-6-hydroxy-2-thioxo-1H-pyrimidin-4-one CAS Name: 5-[(3,4-dimethylphenyl)methyl]-6-hydroxy-2-sulfanylidene-1H-pyrimidin-4-one IUPAC Name: 5-[(3,4-dimethylphenyl)methyl]-6-hydroxy-2-sulfanylidene-1H-pyrimidin-4-one Traditional Name: 5-(3,4-dimethylbenzyl)-6-hydroxy-2-thioxo-1H-pyrimidin-4-one Formula: C13H14N2O2S MolecularWeight: 262.32746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CC2=C(NC(=S)NC2=O)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)CC2=C(NC(=S)NC2=O)O)C

InChI

InChI=1S/C13H14N2O2S/c1-7-3-4-9(5-8(7)2)6-10-11(16)14-13(18)15-12(10)17/h3-5H,6H2,1-2H3,(H3,14,15,16,17,18)