N-[(2-chlorophenyl)methyl]-2-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[(2-chlorophenyl)methyl]-2-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfanyl-pyridine-3-carboxamide Openeye Name: 2-[2-(benzylamino)-2-oxo-ethyl]sulfanyl-N-[(2-chlorophenyl)methyl]pyridine-3-carboxamide CAS Name: N-[(2-chlorophenyl)methyl]-2-[[2-oxo-2-[(phenylmethyl)amino]ethyl]thio]-3-pyridinecarboxamide IUPAC Name: 2-[2-(benzylamino)-2-oxoethyl]sulfanyl-N-[(2-chlorophenyl)methyl]pyridine-3-carboxamide Traditional Name: 2-[[2-(benzylamino)-2-keto-ethyl]thio]-N-(2-chlorobenzyl)nicotinamide Formula: C22H20ClN3O2S MolecularWeight: 425.9311

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CSC2=C(C=CC=N2)C(=O)NCC3=CC=CC=C3Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CSC2=C(C=CC=N2)C(=O)NCC3=CC=CC=C3Cl

InChI

InChI=1S/C22H20ClN3O2S/c23-19-11-5-4-9-17(19)14-26-21(28)18-10-6-12-24-22(18)29-15-20(27)25-13-16-7-2-1-3-8-16/h1-12H,13-15H2,(H,25,27)(H,26,28)