2-[(4-bromophenyl)methylsulfanyl]-N-(3-ethanoylphenyl)pyridine-3-carboxamide

Systemtic Name: 2-[(4-bromophenyl)methylsulfanyl]-N-(3-ethanoylphenyl)pyridine-3-carboxamide Openeye Name: N-(3-acetylphenyl)-2-[(4-bromophenyl)methylsulfanyl]pyridine-3-carboxamide CAS Name: N-(3-acetylphenyl)-2-[(4-bromophenyl)methylthio]-3-pyridinecarboxamide IUPAC Name: N-(3-acetylphenyl)-2-[(4-bromophenyl)methylsulfanyl]pyridine-3-carboxamide Traditional Name: N-(3-acetylphenyl)-2-[(4-bromobenzyl)thio]nicotinamide Formula: C21H17BrN2O2S MolecularWeight: 441.34088

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)C2=C(N=CC=C2)SCC3=CC=C(C=C3)Br

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)C2=C(N=CC=C2)SCC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H17BrN2O2S/c1-14(25)16-4-2-5-18(12-16)24-20(26)19-6-3-11-23-21(19)27-13-15-7-9-17(22)10-8-15/h2-12H,13H2,1H3,(H,24,26)