[1-(4-bromophenyl)-5-methyl-pyrazol-4-yl]-[4-(3-chlorophenyl)piperazin-1-yl]methanone

Systemtic Name: [1-(4-bromophenyl)-5-methyl-pyrazol-4-yl]-[4-(3-chlorophenyl)piperazin-1-yl]methanone Openeye Name: [1-(4-bromophenyl)-5-methyl-pyrazol-4-yl]-[4-(3-chlorophenyl)piperazin-1-yl]methanone CAS Name: [1-(4-bromophenyl)-5-methyl-4-pyrazolyl]-[4-(3-chlorophenyl)-1-piperazinyl]methanone IUPAC Name: [1-(4-bromophenyl)-5-methylpyrazol-4-yl]-[4-(3-chlorophenyl)piperazin-1-yl]methanone Traditional Name: [1-(4-bromophenyl)-5-methyl-pyrazol-4-yl]-[4-(3-chlorophenyl)piperazino]methanone Formula: C21H20BrClN4O MolecularWeight: 459.7667

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=C(C=C2)Br)C(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=C(C=NN1C2=CC=C(C=C2)Br)C(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

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