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

Systemtic Name: 5-[(6-methylpyridin-3-yl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one Openeye Name: 5-[(6-methyl-3-pyridyl)methyl]-2-thioxo-1H-pyrimidin-4-one CAS Name: 5-[(6-methyl-3-pyridinyl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one IUPAC Name: 5-[(6-methylpyridin-3-yl)methyl]-2-sulfanylidene-1H-pyrimidin-4-one Traditional Name: 5-[(6-methyl-3-pyridyl)methyl]-2-thioxo-1H-pyrimidin-4-one Formula: C11H11N3OS MolecularWeight: 233.28954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11N3OS/c1-7-2-3-8(5-12-7)4-9-6-13-11(16)14-10(9)15/h2-3,5-6H,4H2,1H3,(H2,13,14,15,16)