6-[4-(2-bromophenyl)carbonylpiperazin-1-yl]-N-phenethyl-pyridine-3-carboxamide

Systemtic Name: 6-[4-(2-bromophenyl)carbonylpiperazin-1-yl]-N-phenethyl-pyridine-3-carboxamide Openeye Name: 6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-phenethyl-pyridine-3-carboxamide CAS Name: 6-[4-[(2-bromophenyl)-oxomethyl]-1-piperazinyl]-N-phenethyl-3-pyridinecarboxamide IUPAC Name: 6-[4-(2-bromobenzoyl)piperazin-1-yl]-N-phenethylpyridine-3-carboxamide Traditional Name: 6-[4-(2-bromobenzoyl)piperazino]-N-phenethyl-nicotinamide Formula: C25H25BrN4O2 MolecularWeight: 493.3956

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)C(=O)NCCC3=CC=CC=C3)C(=O)C4=CC=CC=C4Br

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)C(=O)NCCC3=CC=CC=C3)C(=O)C4=CC=CC=C4Br

InChI

InChI=1S/C25H25BrN4O2/c26-22-9-5-4-8-21(22)25(32)30-16-14-29(15-17-30)23-11-10-20(18-28-23)24(31)27-13-12-19-6-2-1-3-7-19/h1-11,18H,12-17H2,(H,27,31)