4-[[6-azanyl-4-oxidanylidene-2-(trifluoromethyl)quinazolin-3-yl]methyl]benzenesulfonamide

Systemtic Name: 4-[[6-azanyl-4-oxidanylidene-2-(trifluoromethyl)quinazolin-3-yl]methyl]benzenesulfonamide Openeye Name: 4-[[6-amino-4-oxo-2-(trifluoromethyl)quinazolin-3-yl]methyl]benzenesulfonamide CAS Name: 4-[[6-amino-4-oxo-2-(trifluoromethyl)-3-quinazolinyl]methyl]benzenesulfonamide IUPAC Name: 4-[[6-amino-4-oxo-2-(trifluoromethyl)quinazolin-3-yl]methyl]benzenesulfonamide Traditional Name: 4-[[6-amino-4-keto-2-(trifluoromethyl)quinazolin-3-yl]methyl]benzenesulfonamide Formula: C16H13F3N4O3S MolecularWeight: 398.35963

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C(=O)C3=C(C=CC(=C3)N)N=C2C(F)(F)F)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1CN2C(=O)C3=C(C=CC(=C3)N)N=C2C(F)(F)F)S(=O)(=O)N

InChI

InChI=1S/C16H13F3N4O3S/c17-16(18,19)15-22-13-6-3-10(20)7-12(13)14(24)23(15)8-9-1-4-11(5-2-9)27(21,25)26/h1-7H,8,20H2,(H2,21,25,26)