4-bromanyl-1-methyl-5-(oxidanidylamino)-N-[4-[3-(trifluoromethyl)phenoxy]phenyl]pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-1-methyl-5-(oxidanidylamino)-N-[4-[3-(trifluoromethyl)phenoxy]phenyl]pyrazole-3-carboxamide Openeye Name: 4-bromo-1-methyl-5-(oxidoamino)-N-[4-[3-(trifluoromethyl)phenoxy]phenyl]pyrazole-3-carboxamide CAS Name: 4-bromo-1-methyl-5-(oxidoamino)-N-[4-[3-(trifluoromethyl)phenoxy]phenyl]-3-pyrazolecarboxamide IUPAC Name: 4-bromo-1-methyl-5-(oxidoamino)-N-[4-[3-(trifluoromethyl)phenoxy]phenyl]pyrazole-3-carboxamide Traditional Name: 4-bromo-1-methyl-5-(oxidoamino)-N-[4-[3-(trifluoromethyl)phenoxy]phenyl]pyrazole-3-carboxamide Formula: C18H13BrF3N4O3- MolecularWeight: 470.22003

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C(=O)NC2=CC=C(C=C2)OC3=CC=CC(=C3)C(F)(F)F)Br)N[O-]

Isomeric SMILES

CN1C(=C(C(=N1)C(=O)NC2=CC=C(C=C2)OC3=CC=CC(=C3)C(F)(F)F)Br)N[O-]

InChI

InChI=1S/C18H13BrF3N4O3/c1-26-16(25-28)14(19)15(24-26)17(27)23-11-5-7-12(8-6-11)29-13-4-2-3-10(9-13)18(20,21)22/h2-9,25H,1H3,(H,23,27)/q-1