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

Systemtic Name: 4-[[4-[5-(furan-2-yl)-2-phenyl-pyrazol-3-yl]carbonylpiperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[5-(2-furyl)-2-phenyl-pyrazole-3-carbonyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[[5-(2-furanyl)-2-phenyl-3-pyrazolyl]-oxomethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-[5-(furan-2-yl)-2-phenylpyrazole-3-carbonyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[5-(2-furyl)-2-phenyl-pyrazole-3-carbonyl]piperazino]methyl]benzonitrile Formula: C26H23N5O2 MolecularWeight: 437.49312

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)C3=CC(=NN3C4=CC=CC=C4)C5=CC=CO5

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)C3=CC(=NN3C4=CC=CC=C4)C5=CC=CO5

InChI

InChI=1S/C26H23N5O2/c27-18-20-8-10-21(11-9-20)19-29-12-14-30(15-13-29)26(32)24-17-23(25-7-4-16-33-25)28-31(24)22-5-2-1-3-6-22/h1-11,16-17H,12-15,19H2