methyl 4,5-dimethyl-2-[2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylethanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4,5-dimethyl-2-[2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 4,5-dimethyl-2-[[2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylacetyl]amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[1-oxo-2-[[2-(trifluoromethyl)-4-quinazolinyl]thio]ethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4,5-dimethyl-2-[[2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylacetyl]amino]thiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[[2-[[2-(trifluoromethyl)quinazolin-4-yl]thio]acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C19H16F3N3O3S2 MolecularWeight: 455.47385

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C(F)(F)F)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C(F)(F)F)C

InChI

InChI=1S/C19H16F3N3O3S2/c1-9-10(2)30-16(14(9)17(27)28-3)24-13(26)8-29-15-11-6-4-5-7-12(11)23-18(25-15)19(20,21)22/h4-7H,8H2,1-3H3,(H,24,26)