2-[4-[1-(4-bromophenyl)-5-methyl-pyrazol-4-yl]carbonylpiperazin-1-yl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[4-[1-(4-bromophenyl)-5-methyl-pyrazol-4-yl]carbonylpiperazin-1-yl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[4-[1-(4-bromophenyl)-5-methyl-pyrazole-4-carbonyl]piperazin-1-yl]-1-(1-piperidyl)ethanone CAS Name: 2-[4-[[1-(4-bromophenyl)-5-methyl-4-pyrazolyl]-oxomethyl]-1-piperazinyl]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[4-[1-(4-bromophenyl)-5-methylpyrazole-4-carbonyl]piperazin-1-yl]-1-piperidin-1-ylethanone Traditional Name: 2-[4-[1-(4-bromophenyl)-5-methyl-pyrazole-4-carbonyl]piperazino]-1-piperidino-ethanone Formula: C22H28BrN5O2 MolecularWeight: 474.39402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=C(C=C2)Br)C(=O)N3CCN(CC3)CC(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C=NN1C2=CC=C(C=C2)Br)C(=O)N3CCN(CC3)CC(=O)N4CCCCC4

InChI

InChI=1S/C22H28BrN5O2/c1-17-20(15-24-28(17)19-7-5-18(23)6-8-19)22(30)27-13-11-25(12-14-27)16-21(29)26-9-3-2-4-10-26/h5-8,15H,2-4,9-14,16H2,1H3