5-bromanyl-N-[2-[4-[[3-butyl-5-oxidanylidene-1-[2-(trifluoromethyl)phenyl]-1,2,4-triazol-4-yl]methyl]phenyl]phenyl]sulfonyl-furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[2-[4-[[3-butyl-5-oxidanylidene-1-[2-(trifluoromethyl)phenyl]-1,2,4-triazol-4-yl]methyl]phenyl]phenyl]sulfonyl-furan-2-carboxamide Openeye Name: 5-bromo-N-[2-[4-[[3-butyl-5-oxo-1-[2-(trifluoromethyl)phenyl]-1,2,4-triazol-4-yl]methyl]phenyl]phenyl]sulfonyl-furan-2-carboxamide CAS Name: 5-bromo-N-[2-[4-[[3-butyl-5-oxo-1-[2-(trifluoromethyl)phenyl]-1,2,4-triazol-4-yl]methyl]phenyl]phenyl]sulfonyl-2-furancarboxamide IUPAC Name: 5-bromo-N-[2-[4-[[3-butyl-5-oxo-1-[2-(trifluoromethyl)phenyl]-1,2,4-triazol-4-yl]methyl]phenyl]phenyl]sulfonylfuran-2-carboxamide Traditional Name: 5-bromo-N-[2-[4-[[3-butyl-5-keto-1-[2-(trifluoromethyl)phenyl]-1,2,4-triazol-4-yl]methyl]phenyl]phenyl]sulfonyl-2-furamide Formula: C31H26BrF3N4O5S MolecularWeight: 703.52615

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)NC(=O)C4=CC=C(O4)Br)C5=CC=CC=C5C(F)(F)F

Isomeric SMILES

CCCCC1=NN(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)NC(=O)C4=CC=C(O4)Br)C5=CC=CC=C5C(F)(F)F

InChI

InChI=1S/C31H26BrF3N4O5S/c1-2-3-12-28-36-39(24-10-6-5-9-23(24)31(33,34)35)30(41)38(28)19-20-13-15-21(16-14-20)22-8-4-7-11-26(22)45(42,43)37-29(40)25-17-18-27(32)44-25/h4-11,13-18H,2-3,12,19H2,1H3,(H,37,40)