1-methyl-5-[(1-methyl-2-oxidanylidene-pyridin-4-yl)methyl]-2-sulfanylidene-pyrimidin-4-one

Systemtic Name: 1-methyl-5-[(1-methyl-2-oxidanylidene-pyridin-4-yl)methyl]-2-sulfanylidene-pyrimidin-4-one Openeye Name: 1-methyl-5-[(1-methyl-2-oxo-4-pyridyl)methyl]-2-thioxo-pyrimidin-4-one CAS Name: 1-methyl-5-[(1-methyl-2-oxo-4-pyridinyl)methyl]-2-sulfanylidene-4-pyrimidinone IUPAC Name: 1-methyl-5-[(1-methyl-2-oxopyridin-4-yl)methyl]-2-sulfanylidenepyrimidin-4-one Traditional Name: 5-[(2-keto-1-methyl-4-pyridyl)methyl]-1-methyl-2-thioxo-pyrimidin-4-one Formula: C12H13N3O2S MolecularWeight: 263.31552

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=CC1=O)CC2=CN(C(=S)NC2=O)C

Isomeric SMILES

CN1C=CC(=CC1=O)CC2=CN(C(=S)NC2=O)C

InChI

InChI=1S/C12H13N3O2S/c1-14-4-3-8(6-10(14)16)5-9-7-15(2)12(18)13-11(9)17/h3-4,6-7H,5H2,1-2H3,(H,13,17,18)