N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: N-[1-(2-amino-2-oxo-ethyl)-4-piperidyl]-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: N-[1-(2-amino-2-oxoethyl)-4-piperidinyl]-1-phenyl-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: N-[1-(2-amino-2-keto-ethyl)-4-piperidyl]-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C18H20F3N5O2 MolecularWeight: 395.37891

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=C(N(N=C2)C3=CC=CC=C3)C(F)(F)F)CC(=O)N

Isomeric SMILES

C1CN(CCC1NC(=O)C2=C(N(N=C2)C3=CC=CC=C3)C(F)(F)F)CC(=O)N

InChI

InChI=1S/C18H20F3N5O2/c19-18(20,21)16-14(10-23-26(16)13-4-2-1-3-5-13)17(28)24-12-6-8-25(9-7-12)11-15(22)27/h1-5,10,12H,6-9,11H2,(H2,22,27)(H,24,28)