2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(2-fluorophenyl)-3-oxidanylidene-piperazine-1-carboxamide

Systemtic Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(2-fluorophenyl)-3-oxidanylidene-piperazine-1-carboxamide Openeye Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(2-fluorophenyl)-3-oxo-piperazine-1-carboxamide CAS Name: 2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-N-(2-fluorophenyl)-3-oxo-1-piperazinecarboxamide IUPAC Name: 2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-N-(2-fluorophenyl)-3-oxopiperazine-1-carboxamide Traditional Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(2-fluorophenyl)-3-keto-piperazine-1-carboxamide Formula: C22H22FN5O2 MolecularWeight: 407.440783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C3C(=O)NCCN3C(=O)NC4=CC=CC=C4F

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C3C(=O)NCCN3C(=O)NC4=CC=CC=C4F

InChI

InChI=1S/C22H22FN5O2/c1-14-19(15(2)28(26-14)16-8-4-3-5-9-16)20-21(29)24-12-13-27(20)22(30)25-18-11-7-6-10-17(18)23/h3-11,20H,12-13H2,1-2H3,(H,24,29)(H,25,30)