N-(4-bromanyl-2-methyl-phenyl)-2-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]propanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]propanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[4-(4-chlorobenzoyl)piperazin-1-yl]propanamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[4-[(4-chlorophenyl)-oxomethyl]-1-piperazinyl]propanamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[4-(4-chlorobenzoyl)piperazin-1-yl]propanamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[4-(4-chlorobenzoyl)piperazino]propionamide Formula: C21H23BrClN3O2 MolecularWeight: 464.78322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23BrClN3O2/c1-14-13-17(22)5-8-19(14)24-20(27)15(2)25-9-11-26(12-10-25)21(28)16-3-6-18(23)7-4-16/h3-8,13,15H,9-12H2,1-2H3,(H,24,27)