4-bromanyl-N-[3-chloranyl-2-[4-(4-methylphenyl)carbonylpiperazin-1-yl]phenyl]benzamide

Systemtic Name: 4-bromanyl-N-[3-chloranyl-2-[4-(4-methylphenyl)carbonylpiperazin-1-yl]phenyl]benzamide Openeye Name: 4-bromo-N-[3-chloro-2-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]benzamide CAS Name: 4-bromo-N-[3-chloro-2-[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]benzamide IUPAC Name: 4-bromo-N-[3-chloro-2-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]benzamide Traditional Name: 4-bromo-N-[3-chloro-2-(4-p-toluoylpiperazino)phenyl]benzamide Formula: C25H23BrClN3O2 MolecularWeight: 512.82602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)NC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)NC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C25H23BrClN3O2/c1-17-5-7-19(8-6-17)25(32)30-15-13-29(14-16-30)23-21(27)3-2-4-22(23)28-24(31)18-9-11-20(26)12-10-18/h2-12H,13-16H2,1H3,(H,28,31)