2-(4-bromophenyl)sulfanyl-N-butan-2-yl-pyridine-3-carboxamide

Systemtic Name: 2-(4-bromophenyl)sulfanyl-N-butan-2-yl-pyridine-3-carboxamide Openeye Name: 2-(4-bromophenyl)sulfanyl-N-sec-butyl-pyridine-3-carboxamide CAS Name: 2-[(4-bromophenyl)thio]-N-butan-2-yl-3-pyridinecarboxamide IUPAC Name: 2-(4-bromophenyl)sulfanyl-N-butan-2-ylpyridine-3-carboxamide Traditional Name: 2-[(4-bromophenyl)thio]-N-sec-butyl-nicotinamide Formula: C16H17BrN2OS MolecularWeight: 365.28798

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(N=CC=C1)SC2=CC=C(C=C2)Br

Isomeric SMILES

CCC(C)NC(=O)C1=C(N=CC=C1)SC2=CC=C(C=C2)Br

InChI

InChI=1S/C16H17BrN2OS/c1-3-11(2)19-15(20)14-5-4-10-18-16(14)21-13-8-6-12(17)7-9-13/h4-11H,3H2,1-2H3,(H,19,20)