3-ethyl-4-oxidanylidene-2-sulfanylidene-N-[4-[2,2,2-tris(fluoranyl)ethylsulfamoyl]phenyl]-1H-quinazoline-7-carboxamide

Systemtic Name: 3-ethyl-4-oxidanylidene-2-sulfanylidene-N-[4-[2,2,2-tris(fluoranyl)ethylsulfamoyl]phenyl]-1H-quinazoline-7-carboxamide Openeye Name: 3-ethyl-4-oxo-2-thioxo-N-[4-(2,2,2-trifluoroethylsulfamoyl)phenyl]-1H-quinazoline-7-carboxamide CAS Name: 3-ethyl-4-oxo-2-sulfanylidene-N-[4-(2,2,2-trifluoroethylsulfamoyl)phenyl]-1H-quinazoline-7-carboxamide IUPAC Name: 3-ethyl-4-oxo-2-sulfanylidene-N-[4-(2,2,2-trifluoroethylsulfamoyl)phenyl]-1H-quinazoline-7-carboxamide Traditional Name: 3-ethyl-4-keto-2-thioxo-N-[4-(2,2,2-trifluoroethylsulfamoyl)phenyl]-1H-quinazoline-7-carboxamide Formula: C19H17F3N4O4S2 MolecularWeight: 486.48789

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)NCC(F)(F)F)NC1=S

Isomeric SMILES

CCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)NCC(F)(F)F)NC1=S

InChI

InChI=1S/C19H17F3N4O4S2/c1-2-26-17(28)14-8-3-11(9-15(14)25-18(26)31)16(27)24-12-4-6-13(7-5-12)32(29,30)23-10-19(20,21)22/h3-9,23H,2,10H2,1H3,(H,24,27)(H,25,31)