[4-[1-(4-bromophenyl)-5-methyl-pyrazol-4-yl]carbonylpiperazin-1-yl]-phenyl-methanone

Systemtic Name: [4-[1-(4-bromophenyl)-5-methyl-pyrazol-4-yl]carbonylpiperazin-1-yl]-phenyl-methanone Openeye Name: [4-[1-(4-bromophenyl)-5-methyl-pyrazole-4-carbonyl]piperazin-1-yl]-phenyl-methanone CAS Name: [4-[[1-(4-bromophenyl)-5-methyl-4-pyrazolyl]-oxomethyl]-1-piperazinyl]-phenylmethanone IUPAC Name: [4-[1-(4-bromophenyl)-5-methylpyrazole-4-carbonyl]piperazin-1-yl]-phenylmethanone Traditional Name: [4-[1-(4-bromophenyl)-5-methyl-pyrazole-4-carbonyl]piperazino]-phenyl-methanone Formula: C22H21BrN4O2 MolecularWeight: 453.33174

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21BrN4O2/c1-16-20(15-24-27(16)19-9-7-18(23)8-10-19)22(29)26-13-11-25(12-14-26)21(28)17-5-3-2-4-6-17/h2-10,15H,11-14H2,1H3