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

Systemtic Name: 4-[2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-oxidanylidene-piperazin-1-yl]ethoxy]benzenecarbonitrile Openeye Name: 4-[2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-oxo-piperazin-1-yl]ethoxy]benzonitrile CAS Name: 4-[2-[2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-3-oxo-1-piperazinyl]ethoxy]benzonitrile IUPAC Name: 4-[2-[2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-oxopiperazin-1-yl]ethoxy]benzonitrile Traditional Name: 4-[2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-keto-piperazino]ethoxy]benzonitrile Formula: C24H25N5O2 MolecularWeight: 415.4876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C3C(=O)NCCN3CCOC4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C3C(=O)NCCN3CCOC4=CC=C(C=C4)C#N

InChI

InChI=1S/C24H25N5O2/c1-17-22(18(2)29(27-17)20-6-4-3-5-7-20)23-24(30)26-12-13-28(23)14-15-31-21-10-8-19(16-25)9-11-21/h3-11,23H,12-15H2,1-2H3,(H,26,30)