S-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl) pyridine-3-carbothioate

Systemtic Name: S-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl) pyridine-3-carbothioate Openeye Name: S-(6-methyl-4-oxo-1H-pyrimidin-2-yl) pyridine-3-carbothioate CAS Name: 3-pyridinecarbothioic acid S-(6-methyl-4-oxo-1H-pyrimidin-2-yl) ester IUPAC Name: S-(6-methyl-4-oxo-1H-pyrimidin-2-yl) pyridine-3-carbothioate Traditional Name: pyridine-3-carbothioic acid S-(4-keto-6-methyl-1H-pyrimidin-2-yl) ester Formula: C11H9N3O2S MolecularWeight: 247.27306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SC(=O)C2=CN=CC=C2

Isomeric SMILES

CC1=CC(=O)N=C(N1)SC(=O)C2=CN=CC=C2

InChI

InChI=1S/C11H9N3O2S/c1-7-5-9(15)14-11(13-7)17-10(16)8-3-2-4-12-6-8/h2-6H,1H3,(H,13,14,15)