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

Systemtic Name: 2-[(3-bromophenyl)methylsulfanyl]-N-cyclopropyl-pyridine-3-carboxamide Openeye Name: 2-[(3-bromophenyl)methylsulfanyl]-N-cyclopropyl-pyridine-3-carboxamide CAS Name: 2-[(3-bromophenyl)methylthio]-N-cyclopropyl-3-pyridinecarboxamide IUPAC Name: 2-[(3-bromophenyl)methylsulfanyl]-N-cyclopropylpyridine-3-carboxamide Traditional Name: 2-[(3-bromobenzyl)thio]-N-cyclopropyl-nicotinamide Formula: C16H15BrN2OS MolecularWeight: 363.2721

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=C(N=CC=C2)SCC3=CC(=CC=C3)Br

Isomeric SMILES

C1CC1NC(=O)C2=C(N=CC=C2)SCC3=CC(=CC=C3)Br

InChI

InChI=1S/C16H15BrN2OS/c17-12-4-1-3-11(9-12)10-21-16-14(5-2-8-18-16)15(20)19-13-6-7-13/h1-5,8-9,13H,6-7,10H2,(H,19,20)