4-[[4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)carbonylpiperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)carbonylpiperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-(3,5-dimethyl-1-phenyl-pyrazole-4-carbonyl)piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)-oxomethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-(3,5-dimethyl-1-phenylpyrazole-4-carbonyl)piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-(3,5-dimethyl-1-phenyl-pyrazole-4-carbonyl)piperazino]methyl]benzonitrile Formula: C24H25N5O MolecularWeight: 399.4882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)N3CCN(CC3)CC4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)N3CCN(CC3)CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C24H25N5O/c1-18-23(19(2)29(26-18)22-6-4-3-5-7-22)24(30)28-14-12-27(13-15-28)17-21-10-8-20(16-25)9-11-21/h3-11H,12-15,17H2,1-2H3