propyl N'-(pyridin-2-ylmethyl)-N-[4-(trifluoromethyl)phenyl]carbonyl-carbamimidate

Systemtic Name: propyl N'-(pyridin-2-ylmethyl)-N-[4-(trifluoromethyl)phenyl]carbonyl-carbamimidate Openeye Name: N-[C-propoxy-N-(2-pyridylmethyl)carbonimidoyl]-4-(trifluoromethyl)benzamide CAS Name: N-[oxo-[4-(trifluoromethyl)phenyl]methyl]-N'-(2-pyridinylmethyl)carbamimidic acid propyl ester IUPAC Name: propyl N'-(pyridin-2-ylmethyl)-N-[4-(trifluoromethyl)benzoyl]carbamimidate Traditional Name: N-[C-propoxy-N-(2-pyridylmethyl)carbonimidoyl]-4-(trifluoromethyl)benzamide Formula: C18H18F3N3O2 MolecularWeight: 365.34963

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=NCC1=CC=CC=N1)NC(=O)C2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CCCOC(=NCC1=CC=CC=N1)NC(=O)C2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C18H18F3N3O2/c1-2-11-26-17(23-12-15-5-3-4-10-22-15)24-16(25)13-6-8-14(9-7-13)18(19,20)21/h3-10H,2,11-12H2,1H3,(H,23,24,25)