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

Systemtic Name: [1-(4-bromophenyl)-5-methyl-pyrazol-4-yl]-[4-(3-methylphenyl)piperazin-1-yl]methanone Openeye Name: [1-(4-bromophenyl)-5-methyl-pyrazol-4-yl]-[4-(m-tolyl)piperazin-1-yl]methanone CAS Name: [1-(4-bromophenyl)-5-methyl-4-pyrazolyl]-[4-(3-methylphenyl)-1-piperazinyl]methanone IUPAC Name: [1-(4-bromophenyl)-5-methylpyrazol-4-yl]-[4-(3-methylphenyl)piperazin-1-yl]methanone Traditional Name: [1-(4-bromophenyl)-5-methyl-pyrazol-4-yl]-[4-(m-tolyl)piperazino]methanone Formula: C22H23BrN4O MolecularWeight: 439.34822

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23BrN4O/c1-16-4-3-5-20(14-16)25-10-12-26(13-11-25)22(28)21-15-24-27(17(21)2)19-8-6-18(23)7-9-19/h3-9,14-15H,10-13H2,1-2H3