(4-chlorophenyl)methyl 6-sulfanylidene-1H-pyridine-2-carboxylate

Systemtic Name: (4-chlorophenyl)methyl 6-sulfanylidene-1H-pyridine-2-carboxylate Openeye Name: (4-chlorophenyl)methyl 6-thioxo-1H-pyridine-2-carboxylate CAS Name: 6-sulfanylidene-1H-pyridine-2-carboxylic acid (4-chlorophenyl)methyl ester IUPAC Name: (4-chlorophenyl)methyl 6-sulfanylidene-1H-pyridine-2-carboxylate Traditional Name: 6-thioxo-1H-pyridine-2-carboxylic acid (4-chlorobenzyl) ester Formula: C13H10ClNO2S MolecularWeight: 279.742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=S)NC(=C1)C(=O)OCC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC(=S)NC(=C1)C(=O)OCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H10ClNO2S/c14-10-6-4-9(5-7-10)8-17-13(16)11-2-1-3-12(18)15-11/h1-7H,8H2,(H,15,18)