1-[4-(1-oxidanyl-2H-pyridin-5-yl)-4-[3-(trifluoromethyl)phenyl]butyl]urea

Systemtic Name: 1-[4-(1-oxidanyl-2H-pyridin-5-yl)-4-[3-(trifluoromethyl)phenyl]butyl]urea Openeye Name: [4-(1-hydroxy-2H-pyridin-5-yl)-4-[3-(trifluoromethyl)phenyl]butyl]urea CAS Name: [4-(1-hydroxy-2H-pyridin-5-yl)-4-[3-(trifluoromethyl)phenyl]butyl]urea IUPAC Name: [4-(1-hydroxy-2H-pyridin-5-yl)-4-[3-(trifluoromethyl)phenyl]butyl]urea Traditional Name: [4-(1-hydroxy-2H-pyridin-5-yl)-4-[3-(trifluoromethyl)phenyl]butyl]urea Formula: C17H20F3N3O2 MolecularWeight: 355.35481

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(=CN1O)C(CCCNC(=O)N)C2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

C1C=CC(=CN1O)C(CCCNC(=O)N)C2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C17H20F3N3O2/c18-17(19,20)14-6-1-4-12(10-14)15(7-2-8-22-16(21)24)13-5-3-9-23(25)11-13/h1,3-6,10-11,15,25H,2,7-9H2,(H3,21,22,24)