(3-methylphenyl)methyl 6-sulfanylidene-1H-pyridine-2-carboxylate

Systemtic Name: (3-methylphenyl)methyl 6-sulfanylidene-1H-pyridine-2-carboxylate Openeye Name: m-tolylmethyl 6-thioxo-1H-pyridine-2-carboxylate CAS Name: 6-sulfanylidene-1H-pyridine-2-carboxylic acid (3-methylphenyl)methyl ester IUPAC Name: (3-methylphenyl)methyl 6-sulfanylidene-1H-pyridine-2-carboxylate Traditional Name: 6-thioxo-1H-pyridine-2-carboxylic acid (3-methylbenzyl) ester Formula: C14H13NO2S MolecularWeight: 259.32352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COC(=O)C2=CC=CC(=S)N2

Isomeric SMILES

CC1=CC(=CC=C1)COC(=O)C2=CC=CC(=S)N2

InChI

InChI=1S/C14H13NO2S/c1-10-4-2-5-11(8-10)9-17-14(16)12-6-3-7-13(18)15-12/h2-8H,9H2,1H3,(H,15,18)