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

Systemtic Name: 3-ethyl-N-methyl-4-oxidanylidene-2-sulfanylidene-N-[[4-(trifluoromethyloxy)phenyl]methyl]-1H-quinazoline-7-carboxamide Openeye Name: 3-ethyl-N-methyl-4-oxo-2-thioxo-N-[[4-(trifluoromethoxy)phenyl]methyl]-1H-quinazoline-7-carboxamide CAS Name: 3-ethyl-N-methyl-4-oxo-2-sulfanylidene-N-[[4-(trifluoromethoxy)phenyl]methyl]-1H-quinazoline-7-carboxamide IUPAC Name: 3-ethyl-N-methyl-4-oxo-2-sulfanylidene-N-[[4-(trifluoromethoxy)phenyl]methyl]-1H-quinazoline-7-carboxamide Traditional Name: 3-ethyl-4-keto-N-methyl-2-thioxo-N-[4-(trifluoromethoxy)benzyl]-1H-quinazoline-7-carboxamide Formula: C20H18F3N3O3S MolecularWeight: 437.43543

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=C(C=C2)C(=O)N(C)CC3=CC=C(C=C3)OC(F)(F)F)NC1=S

Isomeric SMILES

CCN1C(=O)C2=C(C=C(C=C2)C(=O)N(C)CC3=CC=C(C=C3)OC(F)(F)F)NC1=S

InChI

InChI=1S/C20H18F3N3O3S/c1-3-26-18(28)15-9-6-13(10-16(15)24-19(26)30)17(27)25(2)11-12-4-7-14(8-5-12)29-20(21,22)23/h4-10H,3,11H2,1-2H3,(H,24,30)