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

Systemtic Name: 5-[(5,6-dimethylpyridin-3-yl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one Openeye Name: 5-[(5,6-dimethyl-3-pyridyl)methyl]-2-thioxo-1H-pyrimidin-4-one CAS Name: 5-[(5,6-dimethyl-3-pyridinyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one IUPAC Name: 5-[(5,6-dimethylpyridin-3-yl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one Traditional Name: 5-[(5,6-dimethyl-3-pyridyl)methyl]-2-thioxo-1H-pyrimidin-4-one Formula: C12H13N3OS MolecularWeight: 247.31612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC(=C1)CC2=CNC(=S)NC2=O)C

Isomeric SMILES

CC1=C(N=CC(=C1)CC2=CNC(=S)NC2=O)C

InChI

InChI=1S/C12H13N3OS/c1-7-3-9(5-13-8(7)2)4-10-6-14-12(17)15-11(10)16/h3,5-6H,4H2,1-2H3,(H2,14,15,16,17)