1-[4-bromanyl-2-(trifluoromethyloxy)phenyl]-3-(2-methylpyrazol-3-yl)thiourea

Systemtic Name: 1-[4-bromanyl-2-(trifluoromethyloxy)phenyl]-3-(2-methylpyrazol-3-yl)thiourea Openeye Name: 1-[4-bromo-2-(trifluoromethoxy)phenyl]-3-(2-methylpyrazol-3-yl)thiourea CAS Name: 1-[4-bromo-2-(trifluoromethoxy)phenyl]-3-(2-methyl-3-pyrazolyl)thiourea IUPAC Name: 1-[4-bromo-2-(trifluoromethoxy)phenyl]-3-(2-methylpyrazol-3-yl)thiourea Traditional Name: 1-[4-bromo-2-(trifluoromethoxy)phenyl]-3-(2-methylpyrazol-3-yl)thiourea Formula: C12H10BrF3N4OS MolecularWeight: 395.19821

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)NC(=S)NC2=C(C=C(C=C2)Br)OC(F)(F)F

Isomeric SMILES

CN1C(=CC=N1)NC(=S)NC2=C(C=C(C=C2)Br)OC(F)(F)F

InChI

InChI=1S/C12H10BrF3N4OS/c1-20-10(4-5-17-20)19-11(22)18-8-3-2-7(13)6-9(8)21-12(14,15)16/h2-6H,1H3,(H2,18,19,22)