3-(3-bromophenyl)-N-(4-methylpiperazin-1-yl)-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 3-(3-bromophenyl)-N-(4-methylpiperazin-1-yl)-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-(3-bromophenyl)-N-(4-methylpiperazin-1-yl)-1-phenyl-pyrazole-4-carboxamide CAS Name: 3-(3-bromophenyl)-N-(4-methyl-1-piperazinyl)-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3-(3-bromophenyl)-N-(4-methylpiperazin-1-yl)-1-phenylpyrazole-4-carboxamide Traditional Name: 3-(3-bromophenyl)-N-(4-methylpiperazino)-1-phenyl-pyrazole-4-carboxamide Formula: C21H22BrN5O MolecularWeight: 440.33628

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)NC(=O)C2=CN(N=C2C3=CC(=CC=C3)Br)C4=CC=CC=C4

Isomeric SMILES

CN1CCN(CC1)NC(=O)C2=CN(N=C2C3=CC(=CC=C3)Br)C4=CC=CC=C4

InChI

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