1-[4-chloranyl-5-methoxy-6-(trifluoromethyl)pyrimidin-2-yl]-1-(2-nitrophenyl)urea

Systemtic Name: 1-[4-chloranyl-5-methoxy-6-(trifluoromethyl)pyrimidin-2-yl]-1-(2-nitrophenyl)urea Openeye Name: 1-[4-chloro-5-methoxy-6-(trifluoromethyl)pyrimidin-2-yl]-1-(2-nitrophenyl)urea CAS Name: 1-[4-chloro-5-methoxy-6-(trifluoromethyl)-2-pyrimidinyl]-1-(2-nitrophenyl)urea IUPAC Name: 1-[4-chloro-5-methoxy-6-(trifluoromethyl)pyrimidin-2-yl]-1-(2-nitrophenyl)urea Traditional Name: 1-[4-chloro-5-methoxy-6-(trifluoromethyl)pyrimidin-2-yl]-1-(2-nitrophenyl)urea Formula: C13H9ClF3N5O4 MolecularWeight: 391.68987

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(N=C(N=C1Cl)N(C2=CC=CC=C2[N+](=O)[O-])C(=O)N)C(F)(F)F

Isomeric SMILES

COC1=C(N=C(N=C1Cl)N(C2=CC=CC=C2[N+](=O)[O-])C(=O)N)C(F)(F)F

InChI

InChI=1S/C13H9ClF3N5O4/c1-26-8-9(13(15,16)17)19-12(20-10(8)14)21(11(18)23)6-4-2-3-5-7(6)22(24)25/h2-5H,1H3,(H2,18,23)