5-(4-nitrophenyl)-N-phenethyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

Systemtic Name: 5-(4-nitrophenyl)-N-phenethyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide Openeye Name: 5-(4-nitrophenyl)-N-phenethyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide CAS Name: 5-(4-nitrophenyl)-N-phenethyl-7-(trifluoromethyl)-2-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: 5-(4-nitrophenyl)-N-phenethyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide Traditional Name: 5-(4-nitrophenyl)-N-phenethyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide Formula: C22H16F3N5O3 MolecularWeight: 455.38935

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C2=NN3C(=CC(=NC3=C2)C4=CC=C(C=C4)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)C2=NN3C(=CC(=NC3=C2)C4=CC=C(C=C4)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C22H16F3N5O3/c23-22(24,25)19-12-17(15-6-8-16(9-7-15)30(32)33)27-20-13-18(28-29(19)20)21(31)26-11-10-14-4-2-1-3-5-14/h1-9,12-13H,10-11H2,(H,26,31)