1-(2-methyl-2,3-dihydroindol-1-yl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-propan-1-one

Systemtic Name: 1-(2-methyl-2,3-dihydroindol-1-yl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-propan-1-one Openeye Name: 1-(2-methylindolin-1-yl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-propan-1-one CAS Name: 1-(2-methyl-2,3-dihydroindol-1-yl)-2-[[2-(trifluoromethyl)-4-quinazolinyl]thio]-1-propanone IUPAC Name: 1-(2-methyl-2,3-dihydroindol-1-yl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylpropan-1-one Traditional Name: 1-(2-methylindolin-1-yl)-2-[[2-(trifluoromethyl)quinazolin-4-yl]thio]propan-1-one Formula: C21H18F3N3OS MolecularWeight: 417.44733

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)C(C)SC3=NC(=NC4=CC=CC=C43)C(F)(F)F

Isomeric SMILES

CC1CC2=CC=CC=C2N1C(=O)C(C)SC3=NC(=NC4=CC=CC=C43)C(F)(F)F

InChI

InChI=1S/C21H18F3N3OS/c1-12-11-14-7-3-6-10-17(14)27(12)19(28)13(2)29-18-15-8-4-5-9-16(15)25-20(26-18)21(22,23)24/h3-10,12-13H,11H2,1-2H3