3-(3-methoxypropyl)-N-methyl-4-oxidanylidene-2-sulfanylidene-N-[[2-(trifluoromethyloxy)phenyl]methyl]-1H-quinazoline-7-carboxamide

Systemtic Name: 3-(3-methoxypropyl)-N-methyl-4-oxidanylidene-2-sulfanylidene-N-[[2-(trifluoromethyloxy)phenyl]methyl]-1H-quinazoline-7-carboxamide Openeye Name: 3-(3-methoxypropyl)-N-methyl-4-oxo-2-thioxo-N-[[2-(trifluoromethoxy)phenyl]methyl]-1H-quinazoline-7-carboxamide CAS Name: 3-(3-methoxypropyl)-N-methyl-4-oxo-2-sulfanylidene-N-[[2-(trifluoromethoxy)phenyl]methyl]-1H-quinazoline-7-carboxamide IUPAC Name: 3-(3-methoxypropyl)-N-methyl-4-oxo-2-sulfanylidene-N-[[2-(trifluoromethoxy)phenyl]methyl]-1H-quinazoline-7-carboxamide Traditional Name: 4-keto-3-(3-methoxypropyl)-N-methyl-2-thioxo-N-[2-(trifluoromethoxy)benzyl]-1H-quinazoline-7-carboxamide Formula: C22H22F3N3O4S MolecularWeight: 481.48799

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1OC(F)(F)F)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CCCOC

Isomeric SMILES

CN(CC1=CC=CC=C1OC(F)(F)F)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CCCOC

InChI

InChI=1S/C22H22F3N3O4S/c1-27(13-15-6-3-4-7-18(15)32-22(23,24)25)19(29)14-8-9-16-17(12-14)26-21(33)28(20(16)30)10-5-11-31-2/h3-4,6-9,12H,5,10-11,13H2,1-2H3,(H,26,33)