1-tert-butyl-3-[4-[[2-oxidanylidene-5-(trifluoromethyl)pyridin-1-yl]methyl]phenyl]urea

Systemtic Name: 1-tert-butyl-3-[4-[[2-oxidanylidene-5-(trifluoromethyl)pyridin-1-yl]methyl]phenyl]urea Openeye Name: 1-tert-butyl-3-[4-[[2-oxo-5-(trifluoromethyl)-1-pyridyl]methyl]phenyl]urea CAS Name: 1-tert-butyl-3-[4-[[2-oxo-5-(trifluoromethyl)-1-pyridinyl]methyl]phenyl]urea IUPAC Name: 1-tert-butyl-3-[4-[[2-oxo-5-(trifluoromethyl)pyridin-1-yl]methyl]phenyl]urea Traditional Name: 1-tert-butyl-3-[4-[[2-keto-5-(trifluoromethyl)-1-pyridyl]methyl]phenyl]urea Formula: C18H20F3N3O2 MolecularWeight: 367.36551

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NC1=CC=C(C=C1)CN2C=C(C=CC2=O)C(F)(F)F

Isomeric SMILES

CC(C)(C)NC(=O)NC1=CC=C(C=C1)CN2C=C(C=CC2=O)C(F)(F)F

InChI

InChI=1S/C18H20F3N3O2/c1-17(2,3)23-16(26)22-14-7-4-12(5-8-14)10-24-11-13(18(19,20)21)6-9-15(24)25/h4-9,11H,10H2,1-3H3,(H2,22,23,26)