5-azanyl-4-[4-bromanyl-3-(trifluoromethyl)phenyl]-2-(trifluoromethyl)thiophen-3-one

Systemtic Name: 5-azanyl-4-[4-bromanyl-3-(trifluoromethyl)phenyl]-2-(trifluoromethyl)thiophen-3-one Openeye Name: 5-amino-4-[4-bromo-3-(trifluoromethyl)phenyl]-2-(trifluoromethyl)thiophen-3-one CAS Name: 5-amino-4-[4-bromo-3-(trifluoromethyl)phenyl]-2-(trifluoromethyl)-3-thiophenone IUPAC Name: 5-amino-4-[4-bromo-3-(trifluoromethyl)phenyl]-2-(trifluoromethyl)thiophen-3-one Traditional Name: 5-amino-4-[4-bromo-3-(trifluoromethyl)phenyl]-2-(trifluoromethyl)thiophen-3-one Formula: C12H6BrF6NOS MolecularWeight: 406.141559

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2=C(SC(C2=O)C(F)(F)F)N)C(F)(F)F)Br

Isomeric SMILES

C1=CC(=C(C=C1C2=C(SC(C2=O)C(F)(F)F)N)C(F)(F)F)Br

InChI

InChI=1S/C12H6BrF6NOS/c13-6-2-1-4(3-5(6)11(14,15)16)7-8(21)9(12(17,18)19)22-10(7)20/h1-3,9H,20H2