1-(2,5-dimethylthiophen-3-yl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanone

Systemtic Name: 1-(2,5-dimethylthiophen-3-yl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanone Openeye Name: 1-(2,5-dimethyl-3-thienyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanone CAS Name: 1-(2,5-dimethyl-3-thiophenyl)-2-[[2-(trifluoromethyl)-4-quinazolinyl]thio]ethanone IUPAC Name: 1-(2,5-dimethylthiophen-3-yl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylethanone Traditional Name: 1-(2,5-dimethyl-3-thienyl)-2-[[2-(trifluoromethyl)quinazolin-4-yl]thio]ethanone Formula: C17H13F3N2OS2 MolecularWeight: 382.42313

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)CSC2=NC(=NC3=CC=CC=C32)C(F)(F)F

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)CSC2=NC(=NC3=CC=CC=C32)C(F)(F)F

InChI

InChI=1S/C17H13F3N2OS2/c1-9-7-12(10(2)25-9)14(23)8-24-15-11-5-3-4-6-13(11)21-16(22-15)17(18,19)20/h3-7H,8H2,1-2H3