(4-oxidanylidene-1H-quinazolin-2-yl)methyl 4-(trifluoromethylsulfanyl)benzoate

Systemtic Name: (4-oxidanylidene-1H-quinazolin-2-yl)methyl 4-(trifluoromethylsulfanyl)benzoate Openeye Name: (4-oxo-1H-quinazolin-2-yl)methyl 4-(trifluoromethylsulfanyl)benzoate CAS Name: 4-(trifluoromethylthio)benzoic acid (4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-quinazolin-2-yl)methyl 4-(trifluoromethylsulfanyl)benzoate Traditional Name: 4-(trifluoromethylthio)benzoic acid (4-keto-1H-quinazolin-2-yl)methyl ester Formula: C17H11F3N2O3S MolecularWeight: 380.34105

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)COC(=O)C3=CC=C(C=C3)SC(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)COC(=O)C3=CC=C(C=C3)SC(F)(F)F

InChI

InChI=1S/C17H11F3N2O3S/c18-17(19,20)26-11-7-5-10(6-8-11)16(24)25-9-14-21-13-4-2-1-3-12(13)15(23)22-14/h1-8H,9H2,(H,21,22,23)