1-[2-bromanyl-4-fluoranyl-5-[3-methyl-2,6-bis(oxidanylidene)-4-(trifluoromethyl)pyrimidin-1-yl]phenyl]-3-(2-cyanoethyl)urea

Systemtic Name: 1-[2-bromanyl-4-fluoranyl-5-[3-methyl-2,6-bis(oxidanylidene)-4-(trifluoromethyl)pyrimidin-1-yl]phenyl]-3-(2-cyanoethyl)urea Openeye Name: 1-[2-bromo-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]phenyl]-3-(2-cyanoethyl)urea CAS Name: 1-[2-bromo-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-1-pyrimidinyl]phenyl]-3-(2-cyanoethyl)urea IUPAC Name: 1-[2-bromo-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]phenyl]-3-(2-cyanoethyl)urea Traditional Name: 1-[2-bromo-5-[2,6-diketo-3-methyl-4-(trifluoromethyl)pyrimidin-1-yl]-4-fluoro-phenyl]-3-(2-cyanoethyl)urea Formula: C16H12BrF4N5O3 MolecularWeight: 478.195793

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C2=CC(=C(C=C2F)Br)NC(=O)NCCC#N)C(F)(F)F

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C2=CC(=C(C=C2F)Br)NC(=O)NCCC#N)C(F)(F)F

InChI

InChI=1S/C16H12BrF4N5O3/c1-25-12(16(19,20)21)7-13(27)26(15(25)29)11-6-10(8(17)5-9(11)18)24-14(28)23-4-2-3-22/h5-7H,2,4H2,1H3,(H2,23,24,28)