[1-(4-bromophenyl)-5-methyl-pyrazol-4-yl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: [1-(4-bromophenyl)-5-methyl-pyrazol-4-yl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone Openeye Name: [1-(4-bromophenyl)-5-methyl-pyrazol-4-yl]-[4-(2-pyridylmethyl)piperazin-1-yl]methanone CAS Name: [1-(4-bromophenyl)-5-methyl-4-pyrazolyl]-[4-(2-pyridinylmethyl)-1-piperazinyl]methanone IUPAC Name: [1-(4-bromophenyl)-5-methylpyrazol-4-yl]-[4-(pyridin-2-ylmethyl)piperazin-1-yl]methanone Traditional Name: [1-(4-bromophenyl)-5-methyl-pyrazol-4-yl]-[4-(2-pyridylmethyl)piperazino]methanone Formula: C21H22BrN5O MolecularWeight: 440.33628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=C(C=C2)Br)C(=O)N3CCN(CC3)CC4=CC=CC=N4

Isomeric SMILES

CC1=C(C=NN1C2=CC=C(C=C2)Br)C(=O)N3CCN(CC3)CC4=CC=CC=N4

InChI

InChI=1S/C21H22BrN5O/c1-16-20(14-24-27(16)19-7-5-17(22)6-8-19)21(28)26-12-10-25(11-13-26)15-18-4-2-3-9-23-18/h2-9,14H,10-13,15H2,1H3