methyl 5-chloranyl-6-phenylsulfanyl-pyridine-3-carboxylate

Systemtic Name: methyl 5-chloranyl-6-phenylsulfanyl-pyridine-3-carboxylate Openeye Name: methyl 5-chloro-6-phenylsulfanyl-pyridine-3-carboxylate CAS Name: 5-chloro-6-(phenylthio)-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-chloro-6-phenylsulfanylpyridine-3-carboxylate Traditional Name: 5-chloro-6-(phenylthio)nicotinic acid methyl ester Formula: C13H10ClNO2S MolecularWeight: 279.742

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(N=C1)SC2=CC=CC=C2)Cl

Isomeric SMILES

COC(=O)C1=CC(=C(N=C1)SC2=CC=CC=C2)Cl

InChI

InChI=1S/C13H10ClNO2S/c1-17-13(16)9-7-11(14)12(15-8-9)18-10-5-3-2-4-6-10/h2-8H,1H3