4-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-oxidanylidene-piperazin-1-yl]methyl]benzamide

Systemtic Name: 4-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-oxidanylidene-piperazin-1-yl]methyl]benzamide Openeye Name: 4-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-oxo-piperazin-1-yl]methyl]benzamide CAS Name: 4-[[2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-3-oxo-1-piperazinyl]methyl]benzamide IUPAC Name: 4-[[2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-oxopiperazin-1-yl]methyl]benzamide Traditional Name: 4-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-keto-piperazino]methyl]benzamide Formula: C23H25N5O2 MolecularWeight: 403.4769

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C3C(=O)NCCN3CC4=CC=C(C=C4)C(=O)N

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C3C(=O)NCCN3CC4=CC=C(C=C4)C(=O)N

InChI

InChI=1S/C23H25N5O2/c1-15-20(16(2)28(26-15)19-6-4-3-5-7-19)21-23(30)25-12-13-27(21)14-17-8-10-18(11-9-17)22(24)29/h3-11,21H,12-14H2,1-2H3,(H2,24,29)(H,25,30)