1-(2-methylbut-3-yn-2-yl)-3-[4-(trifluoromethyl)pyridin-3-yl]urea

Systemtic Name: 1-(2-methylbut-3-yn-2-yl)-3-[4-(trifluoromethyl)pyridin-3-yl]urea Openeye Name: 1-(1,1-dimethylprop-2-ynyl)-3-[4-(trifluoromethyl)-3-pyridyl]urea CAS Name: 1-(2-methylbut-3-yn-2-yl)-3-[4-(trifluoromethyl)-3-pyridinyl]urea IUPAC Name: 1-(2-methylbut-3-yn-2-yl)-3-[4-(trifluoromethyl)pyridin-3-yl]urea Traditional Name: 1-(1,1-dimethylprop-2-ynyl)-3-[4-(trifluoromethyl)-3-pyridyl]urea Formula: C12H12F3N3O MolecularWeight: 271.23839

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#C)NC(=O)NC1=C(C=CN=C1)C(F)(F)F

Isomeric SMILES

CC(C)(C#C)NC(=O)NC1=C(C=CN=C1)C(F)(F)F

InChI

InChI=1S/C12H12F3N3O/c1-4-11(2,3)18-10(19)17-9-7-16-6-5-8(9)12(13,14)15/h1,5-7H,2-3H3,(H2,17,18,19)