S-(6-methyl-2-pyridin-3-ylcarbonylsulfanyl-pyrimidin-4-yl) pyridine-3-carbothioate

Systemtic Name: S-(6-methyl-2-pyridin-3-ylcarbonylsulfanyl-pyrimidin-4-yl) pyridine-3-carbothioate Openeye Name: S-[6-methyl-2-(pyridine-3-carbonylsulfanyl)pyrimidin-4-yl] pyridine-3-carbothioate CAS Name: 3-pyridinecarbothioic acid S-[6-methyl-2-[[oxo(3-pyridinyl)methyl]thio]-4-pyrimidinyl] ester IUPAC Name: S-[6-methyl-2-(pyridine-3-carbonylsulfanyl)pyrimidin-4-yl] pyridine-3-carbothioate Traditional Name: pyridine-3-carbothioic acid S-[6-methyl-2-(nicotinoylthio)pyrimidin-4-yl] ester Formula: C17H12N4O2S2 MolecularWeight: 368.43278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC(=O)C2=CN=CC=C2)SC(=O)C3=CN=CC=C3

Isomeric SMILES

CC1=CC(=NC(=N1)SC(=O)C2=CN=CC=C2)SC(=O)C3=CN=CC=C3

InChI

InChI=1S/C17H12N4O2S2/c1-11-8-14(24-15(22)12-4-2-6-18-9-12)21-17(20-11)25-16(23)13-5-3-7-19-10-13/h2-10H,1H3