(3-chlorophenyl)methyl 2-[(3-chlorophenyl)methylsulfanyl]pyridine-3-carboxylate

Systemtic Name: (3-chlorophenyl)methyl 2-[(3-chlorophenyl)methylsulfanyl]pyridine-3-carboxylate Openeye Name: (3-chlorophenyl)methyl 2-[(3-chlorophenyl)methylsulfanyl]pyridine-3-carboxylate CAS Name: 2-[(3-chlorophenyl)methylthio]-3-pyridinecarboxylic acid (3-chlorophenyl)methyl ester IUPAC Name: (3-chlorophenyl)methyl 2-[(3-chlorophenyl)methylsulfanyl]pyridine-3-carboxylate Traditional Name: 2-[(3-chlorobenzyl)thio]nicotinic acid (3-chlorobenzyl) ester Formula: C20H15Cl2NO2S MolecularWeight: 404.3096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)COC(=O)C2=C(N=CC=C2)SCC3=CC(=CC=C3)Cl

Isomeric SMILES

C1=CC(=CC(=C1)Cl)COC(=O)C2=C(N=CC=C2)SCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H15Cl2NO2S/c21-16-6-1-4-14(10-16)12-25-20(24)18-8-3-9-23-19(18)26-13-15-5-2-7-17(22)11-15/h1-11H,12-13H2