4-[[4-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)carbonylpiperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-(5-cyclopropyl-2-phenyl-pyrazol-3-yl)carbonylpiperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-(5-cyclopropyl-2-phenyl-pyrazole-3-carbonyl)piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[(5-cyclopropyl-2-phenyl-3-pyrazolyl)-oxomethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-(5-cyclopropyl-2-phenylpyrazole-3-carbonyl)piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-(5-cyclopropyl-2-phenyl-pyrazole-3-carbonyl)piperazino]methyl]benzonitrile Formula: C25H25N5O MolecularWeight: 411.4989

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN(C(=C2)C(=O)N3CCN(CC3)CC4=CC=C(C=C4)C#N)C5=CC=CC=C5

Isomeric SMILES

C1CC1C2=NN(C(=C2)C(=O)N3CCN(CC3)CC4=CC=C(C=C4)C#N)C5=CC=CC=C5

InChI

InChI=1S/C25H25N5O/c26-17-19-6-8-20(9-7-19)18-28-12-14-29(15-13-28)25(31)24-16-23(21-10-11-21)27-30(24)22-4-2-1-3-5-22/h1-9,16,21H,10-15,18H2