[3-(4-bromophenyl)-1H-pyrazol-5-yl]-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]methanone

Systemtic Name: [3-(4-bromophenyl)-1H-pyrazol-5-yl]-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]methanone Openeye Name: [3-(4-bromophenyl)-1H-pyrazol-5-yl]-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]methanone CAS Name: [3-(4-bromophenyl)-1H-pyrazol-5-yl]-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]methanone IUPAC Name: [3-(4-bromophenyl)-1H-pyrazol-5-yl]-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]methanone Traditional Name: [3-(4-bromophenyl)-1H-pyrazol-5-yl]-[4-(5-chloro-2-methyl-phenyl)piperazino]methanone Formula: C21H20BrClN4O MolecularWeight: 459.7667

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3=CC(=NN3)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C3=CC(=NN3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H20BrClN4O/c1-14-2-7-17(23)12-20(14)26-8-10-27(11-9-26)21(28)19-13-18(24-25-19)15-3-5-16(22)6-4-15/h2-7,12-13H,8-11H2,1H3,(H,24,25)