N-(1-cyano-1-cyclopropyl-ethyl)-2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-oxidanylidene-piperazin-1-yl]ethanamide

Systemtic Name: N-(1-cyano-1-cyclopropyl-ethyl)-2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-oxidanylidene-piperazin-1-yl]ethanamide Openeye Name: N-(1-cyano-1-cyclopropyl-ethyl)-2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-oxo-piperazin-1-yl]acetamide CAS Name: N-(1-cyano-1-cyclopropylethyl)-2-[2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-3-oxo-1-piperazinyl]acetamide IUPAC Name: N-(1-cyano-1-cyclopropylethyl)-2-[2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-oxopiperazin-1-yl]acetamide Traditional Name: N-(1-cyano-1-cyclopropyl-ethyl)-2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-keto-piperazino]acetamide Formula: C23H28N6O2 MolecularWeight: 420.50742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C3C(=O)NCCN3CC(=O)NC(C)(C#N)C4CC4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C3C(=O)NCCN3CC(=O)NC(C)(C#N)C4CC4

InChI

InChI=1S/C23H28N6O2/c1-15-20(16(2)29(27-15)18-7-5-4-6-8-18)21-22(31)25-11-12-28(21)13-19(30)26-23(3,14-24)17-9-10-17/h4-8,17,21H,9-13H2,1-3H3,(H,25,31)(H,26,30)