2-[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-[(2-chlorophenyl)methyl]pyridine-3-carboxamide

Systemtic Name: 2-[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-[(2-chlorophenyl)methyl]pyridine-3-carboxamide Openeye Name: 2-[2-(4-bromoanilino)-2-oxo-ethyl]sulfanyl-N-[(2-chlorophenyl)methyl]pyridine-3-carboxamide CAS Name: 2-[[2-(4-bromoanilino)-2-oxoethyl]thio]-N-[(2-chlorophenyl)methyl]-3-pyridinecarboxamide IUPAC Name: 2-[2-(4-bromoanilino)-2-oxoethyl]sulfanyl-N-[(2-chlorophenyl)methyl]pyridine-3-carboxamide Traditional Name: 2-[[2-(4-bromoanilino)-2-keto-ethyl]thio]-N-(2-chlorobenzyl)nicotinamide Formula: C21H17BrClN3O2S MolecularWeight: 490.80058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC(=O)C2=C(N=CC=C2)SCC(=O)NC3=CC=C(C=C3)Br)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CNC(=O)C2=C(N=CC=C2)SCC(=O)NC3=CC=C(C=C3)Br)Cl

InChI

InChI=1S/C21H17BrClN3O2S/c22-15-7-9-16(10-8-15)26-19(27)13-29-21-17(5-3-11-24-21)20(28)25-12-14-4-1-2-6-18(14)23/h1-11H,12-13H2,(H,25,28)(H,26,27)