N-(tert-butylcarbamoyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-propanamide

Systemtic Name: N-(tert-butylcarbamoyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-propanamide Openeye Name: N-(tert-butylcarbamoyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-propanamide CAS Name: N-[(tert-butylamino)-oxomethyl]-2-[[2-(trifluoromethyl)-4-quinazolinyl]thio]propanamide IUPAC Name: N-(tert-butylcarbamoyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylpropanamide Traditional Name: N-(tert-butylcarbamoyl)-2-[[2-(trifluoromethyl)quinazolin-4-yl]thio]propionamide Formula: C17H19F3N4O2S MolecularWeight: 400.41857

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC(C)(C)C)SC1=NC(=NC2=CC=CC=C21)C(F)(F)F

Isomeric SMILES

CC(C(=O)NC(=O)NC(C)(C)C)SC1=NC(=NC2=CC=CC=C21)C(F)(F)F

InChI

InChI=1S/C17H19F3N4O2S/c1-9(12(25)22-15(26)24-16(2,3)4)27-13-10-7-5-6-8-11(10)21-14(23-13)17(18,19)20/h5-9H,1-4H3,(H2,22,24,25,26)