4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(2-cyclopropylpyrimidin-5-yl)-2,5-dimethyl-piperazine-1-carboxamide

Systemtic Name: 4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(2-cyclopropylpyrimidin-5-yl)-2,5-dimethyl-piperazine-1-carboxamide Openeye Name: 4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(2-cyclopropylpyrimidin-5-yl)-2,5-dimethyl-piperazine-1-carboxamide CAS Name: 4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(2-cyclopropyl-5-pyrimidinyl)-2,5-dimethyl-1-piperazinecarboxamide IUPAC Name: 4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(2-cyclopropylpyrimidin-5-yl)-2,5-dimethylpiperazine-1-carboxamide Traditional Name: 4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(2-cyclopropylpyrimidin-5-yl)-2,5-dimethyl-piperazine-1-carboxamide Formula: C22H23F3N6O MolecularWeight: 444.45283

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(CN1C(=O)NC2=CN=C(N=C2)C3CC3)C)C4=CC(=C(C=C4)C#N)C(F)(F)F

Isomeric SMILES

CC1CN(C(CN1C(=O)NC2=CN=C(N=C2)C3CC3)C)C4=CC(=C(C=C4)C#N)C(F)(F)F

InChI

InChI=1S/C22H23F3N6O/c1-13-12-31(21(32)29-17-9-27-20(28-10-17)15-3-4-15)14(2)11-30(13)18-6-5-16(8-26)19(7-18)22(23,24)25/h5-7,9-10,13-15H,3-4,11-12H2,1-2H3,(H,29,32)