5-bromanyl-N-[[4-(butan-2-ylcarbamoyl)phenyl]methyl]pyridine-3-carboxamide

Systemtic Name: 5-bromanyl-N-[[4-(butan-2-ylcarbamoyl)phenyl]methyl]pyridine-3-carboxamide Openeye Name: 5-bromo-N-[[4-(sec-butylcarbamoyl)phenyl]methyl]pyridine-3-carboxamide CAS Name: 5-bromo-N-[[4-[(butan-2-ylamino)-oxomethyl]phenyl]methyl]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-[[4-(butan-2-ylcarbamoyl)phenyl]methyl]pyridine-3-carboxamide Traditional Name: 5-bromo-N-[4-(sec-butylcarbamoyl)benzyl]nicotinamide Formula: C18H20BrN3O2 MolecularWeight: 390.2743

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC=C(C=C1)CNC(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

CCC(C)NC(=O)C1=CC=C(C=C1)CNC(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C18H20BrN3O2/c1-3-12(2)22-18(24)14-6-4-13(5-7-14)9-21-17(23)15-8-16(19)11-20-10-15/h4-8,10-12H,3,9H2,1-2H3,(H,21,23)(H,22,24)