2-[3-(1-methoxypropan-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[4-(trifluoromethyl)phenyl]propanamide

Systemtic Name: 2-[3-(1-methoxypropan-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[4-(trifluoromethyl)phenyl]propanamide Openeye Name: 2-[3-(2-methoxy-1-methyl-ethyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-[4-(trifluoromethyl)phenyl]propanamide CAS Name: 2-[[3-(1-methoxypropan-2-yl)-4-oxo-2-quinazolinyl]thio]-N-[4-(trifluoromethyl)phenyl]propanamide IUPAC Name: 2-[3-(1-methoxypropan-2-yl)-4-oxoquinazolin-2-yl]sulfanyl-N-[4-(trifluoromethyl)phenyl]propanamide Traditional Name: 2-[[4-keto-3-(2-methoxy-1-methyl-ethyl)quinazolin-2-yl]thio]-N-[4-(trifluoromethyl)phenyl]propionamide Formula: C22H22F3N3O3S MolecularWeight: 465.48859

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)N1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC(COC)N1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C22H22F3N3O3S/c1-13(12-31-3)28-20(30)17-6-4-5-7-18(17)27-21(28)32-14(2)19(29)26-16-10-8-15(9-11-16)22(23,24)25/h4-11,13-14H,12H2,1-3H3,(H,26,29)