N-[6-[4-(4-bromophenyl)carbonylpiperazin-1-yl]pyridin-3-yl]-2-phenoxy-ethanamide

Systemtic Name: N-[6-[4-(4-bromophenyl)carbonylpiperazin-1-yl]pyridin-3-yl]-2-phenoxy-ethanamide Openeye Name: N-[6-[4-(4-bromobenzoyl)piperazin-1-yl]-3-pyridyl]-2-phenoxy-acetamide CAS Name: N-[6-[4-[(4-bromophenyl)-oxomethyl]-1-piperazinyl]-3-pyridinyl]-2-phenoxyacetamide IUPAC Name: N-[6-[4-(4-bromobenzoyl)piperazin-1-yl]pyridin-3-yl]-2-phenoxyacetamide Traditional Name: N-[6-[4-(4-bromobenzoyl)piperazino]-3-pyridyl]-2-phenoxy-acetamide Formula: C24H23BrN4O3 MolecularWeight: 495.36842

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)NC(=O)COC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)NC(=O)COC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C24H23BrN4O3/c25-19-8-6-18(7-9-19)24(31)29-14-12-28(13-15-29)22-11-10-20(16-26-22)27-23(30)17-32-21-4-2-1-3-5-21/h1-11,16H,12-15,17H2,(H,27,30)