2-[3-(aminomethyl)phenyl]-N-[4-[(2Z)-2-hydroxyiminopyrrolidin-1-yl]phenyl]-5-(trifluoromethyl)pyrazole-3-carboxamide

Systemtic Name: 2-[3-(aminomethyl)phenyl]-N-[4-[(2Z)-2-hydroxyiminopyrrolidin-1-yl]phenyl]-5-(trifluoromethyl)pyrazole-3-carboxamide Openeye Name: 2-[3-(aminomethyl)phenyl]-N-[4-[(2Z)-2-hydroxyiminopyrrolidin-1-yl]phenyl]-5-(trifluoromethyl)pyrazole-3-carboxamide CAS Name: 2-[3-(aminomethyl)phenyl]-N-[4-[(2Z)-2-hydroxyimino-1-pyrrolidinyl]phenyl]-5-(trifluoromethyl)-3-pyrazolecarboxamide IUPAC Name: 2-[3-(aminomethyl)phenyl]-N-[4-[(2Z)-2-hydroxyiminopyrrolidin-1-yl]phenyl]-5-(trifluoromethyl)pyrazole-3-carboxamide Traditional Name: 2-[3-(aminomethyl)phenyl]-N-[4-[(2Z)-2-hydroximinopyrrolidino]phenyl]-5-(trifluoromethyl)pyrazole-3-carboxamide Formula: C22H21F3N6O2 MolecularWeight: 458.43635

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=NO)N(C1)C2=CC=C(C=C2)NC(=O)C3=CC(=NN3C4=CC=CC(=C4)CN)C(F)(F)F

Isomeric SMILES

C1C/C(=N/O)/N(C1)C2=CC=C(C=C2)NC(=O)C3=CC(=NN3C4=CC=CC(=C4)CN)C(F)(F)F

InChI

InChI=1S/C22H21F3N6O2/c23-22(24,25)19-12-18(31(28-19)17-4-1-3-14(11-17)13-26)21(32)27-15-6-8-16(9-7-15)30-10-2-5-20(30)29-33/h1,3-4,6-9,11-12,33H,2,5,10,13,26H2,(H,27,32)/b29-20-