1-[2-oxidanylidene-5-(trifluoromethyl)-1H-pyridin-3-yl]-3-[(1-phenylcyclopropyl)methyl]urea

Systemtic Name: 1-[2-oxidanylidene-5-(trifluoromethyl)-1H-pyridin-3-yl]-3-[(1-phenylcyclopropyl)methyl]urea Openeye Name: 1-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]-3-[(1-phenylcyclopropyl)methyl]urea CAS Name: 1-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]-3-[(1-phenylcyclopropyl)methyl]urea IUPAC Name: 1-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]-3-[(1-phenylcyclopropyl)methyl]urea Traditional Name: 1-[2-keto-5-(trifluoromethyl)-1H-pyridin-3-yl]-3-[(1-phenylcyclopropyl)methyl]urea Formula: C17H16F3N3O2 MolecularWeight: 351.32305

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1(CNC(=O)NC2=CC(=CNC2=O)C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

C1CC1(CNC(=O)NC2=CC(=CNC2=O)C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C17H16F3N3O2/c18-17(19,20)12-8-13(14(24)21-9-12)23-15(25)22-10-16(6-7-16)11-4-2-1-3-5-11/h1-5,8-9H,6-7,10H2,(H,21,24)(H2,22,23,25)