5-(pyridin-3-ylmethyl)-2-sulfanylidene-1H-pyrimidin-4-one

Systemtic Name: 5-(pyridin-3-ylmethyl)-2-sulfanylidene-1H-pyrimidin-4-one Openeye Name: 5-(3-pyridylmethyl)-2-thioxo-1H-pyrimidin-4-one CAS Name: 5-(3-pyridinylmethyl)-2-sulfanylidene-1H-pyrimidin-4-one IUPAC Name: 5-(pyridin-3-ylmethyl)-2-sulfanylidene-1H-pyrimidin-4-one Traditional Name: 5-(3-pyridylmethyl)-2-thioxo-1H-pyrimidin-4-one Formula: C10H9N3OS MolecularWeight: 219.26296

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9N3OS/c14-9-8(6-12-10(15)13-9)4-7-2-1-3-11-5-7/h1-3,5-6H,4H2,(H2,12,13,14,15)