(2R)-N-(4-acetamidophenyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-propanamide

Systemtic Name: (2R)-N-(4-acetamidophenyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-propanamide Openeye Name: (2R)-N-(4-acetamidophenyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-propanamide CAS Name: (2R)-N-(4-acetamidophenyl)-2-[[2-(trifluoromethyl)-4-quinazolinyl]thio]propanamide IUPAC Name: (2R)-N-(4-acetamidophenyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylpropanamide Traditional Name: (2R)-N-(4-acetamidophenyl)-2-[[2-(trifluoromethyl)quinazolin-4-yl]thio]propionamide Formula: C20H17F3N4O2S MolecularWeight: 434.43479

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)NC(=O)C)SC2=NC(=NC3=CC=CC=C32)C(F)(F)F

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)NC(=O)C)SC2=NC(=NC3=CC=CC=C32)C(F)(F)F

InChI

InChI=1S/C20H17F3N4O2S/c1-11(17(29)25-14-9-7-13(8-10-14)24-12(2)28)30-18-15-5-3-4-6-16(15)26-19(27-18)20(21,22)23/h3-11H,1-2H3,(H,24,28)(H,25,29)/t11-/m1/s1