6-bromanyl-2-(trifluoromethyl)quinazoline-4-thiolate

Systemtic Name: 6-bromanyl-2-(trifluoromethyl)quinazoline-4-thiolate Openeye Name: 6-bromo-2-(trifluoromethyl)quinazoline-4-thiolate CAS Name: 6-bromo-2-(trifluoromethyl)-4-quinazolinethiolate IUPAC Name: 6-bromo-2-(trifluoromethyl)quinazoline-4-thiolate Traditional Name: 6-bromo-2-(trifluoromethyl)quinazoline-4-thiolate Formula: C9H3BrF3N2S- MolecularWeight: 308.09773

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)C(=NC(=N2)C(F)(F)F)[S-]

Isomeric SMILES

C1=CC2=C(C=C1Br)C(=NC(=N2)C(F)(F)F)[S-]

InChI

InChI=1S/C9H4BrF3N2S/c10-4-1-2-6-5(3-4)7(16)15-8(14-6)9(11,12)13/h1-3H,(H,14,15,16)/p-1