N-methyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-methyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-2-[[2-(trifluoromethyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-[(4-keto-1H-quinazolin-2-yl)methyl]-N-methyl-2-[[2-(trifluoromethyl)quinazolin-4-yl]thio]acetamide Formula: C21H16F3N5O2S MolecularWeight: 459.44425

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)CSC3=NC(=NC4=CC=CC=C43)C(F)(F)F

Isomeric SMILES

CN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)CSC3=NC(=NC4=CC=CC=C43)C(F)(F)F

InChI

InChI=1S/C21H16F3N5O2S/c1-29(10-16-25-14-8-4-2-6-12(14)18(31)27-16)17(30)11-32-19-13-7-3-5-9-15(13)26-20(28-19)21(22,23)24/h2-9H,10-11H2,1H3,(H,25,27,31)