8-methyl-2-[[2-(trifluoromethyl)quinazolin-4-yl]sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 8-methyl-2-[[2-(trifluoromethyl)quinazolin-4-yl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 8-methyl-2-[[2-(trifluoromethyl)quinazolin-4-yl]sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 8-methyl-2-[[[2-(trifluoromethyl)-4-quinazolinyl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 8-methyl-2-[[2-(trifluoromethyl)quinazolin-4-yl]sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 8-methyl-2-[[[2-(trifluoromethyl)quinazolin-4-yl]thio]methyl]-1H-quinazolin-4-one Formula: C19H13F3N4OS MolecularWeight: 402.39293

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=NC2=O)CSC3=NC(=NC4=CC=CC=C43)C(F)(F)F

Isomeric SMILES

CC1=CC=CC2=C1NC(=NC2=O)CSC3=NC(=NC4=CC=CC=C43)C(F)(F)F

InChI

InChI=1S/C19H13F3N4OS/c1-10-5-4-7-12-15(10)24-14(25-16(12)27)9-28-17-11-6-2-3-8-13(11)23-18(26-17)19(20,21)22/h2-8H,9H2,1H3,(H,24,25,27)