2-(bromomethyl)-3-[3-(trifluoromethyl)phenyl]quinazoline-4-thione

Systemtic Name: 2-(bromomethyl)-3-[3-(trifluoromethyl)phenyl]quinazoline-4-thione Openeye Name: 2-(bromomethyl)-3-[3-(trifluoromethyl)phenyl]quinazoline-4-thione CAS Name: 2-(bromomethyl)-3-[3-(trifluoromethyl)phenyl]-4-quinazolinethione IUPAC Name: 2-(bromomethyl)-3-[3-(trifluoromethyl)phenyl]quinazoline-4-thione Traditional Name: 2-(bromomethyl)-3-[3-(trifluoromethyl)phenyl]quinazoline-4-thione Formula: C16H10BrF3N2S MolecularWeight: 399.22821

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=S)N(C(=N2)CBr)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=S)N(C(=N2)CBr)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C16H10BrF3N2S/c17-9-14-21-13-7-2-1-6-12(13)15(23)22(14)11-5-3-4-10(8-11)16(18,19)20/h1-8H,9H2