6-methyl-2-(pyridin-3-ylmethylsulfanyl)pyrimidin-4-olate

Systemtic Name: 6-methyl-2-(pyridin-3-ylmethylsulfanyl)pyrimidin-4-olate Openeye Name: 6-methyl-2-(3-pyridylmethylsulfanyl)pyrimidin-4-olate CAS Name: 6-methyl-2-(3-pyridinylmethylthio)-4-pyrimidinolate IUPAC Name: 6-methyl-2-(pyridin-3-ylmethylsulfanyl)pyrimidin-4-olate Traditional Name: 6-methyl-2-(3-pyridylmethylthio)pyrimidin-4-olate Formula: C11H10N3OS- MolecularWeight: 232.2816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CN=CC=C2)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CN=CC=C2)[O-]

InChI

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