4-[2-[3-(2-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethoxy]benzenesulfonamide

Systemtic Name: 4-[2-[3-(2-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethoxy]benzenesulfonamide Openeye Name: 4-[2-[3-(2-chlorophenyl)-4-oxo-quinazolin-2-yl]sulfanylethoxy]benzenesulfonamide CAS Name: 4-[2-[[3-(2-chlorophenyl)-4-oxo-2-quinazolinyl]thio]ethoxy]benzenesulfonamide IUPAC Name: 4-[2-[3-(2-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanylethoxy]benzenesulfonamide Traditional Name: 4-[2-[[3-(2-chlorophenyl)-4-keto-quinazolin-2-yl]thio]ethoxy]benzenesulfonamide Formula: C22H18ClN3O4S2 MolecularWeight: 487.97902

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCCOC3=CC=C(C=C3)S(=O)(=O)N)C4=CC=CC=C4Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCCOC3=CC=C(C=C3)S(=O)(=O)N)C4=CC=CC=C4Cl

InChI

InChI=1S/C22H18ClN3O4S2/c23-18-6-2-4-8-20(18)26-21(27)17-5-1-3-7-19(17)25-22(26)31-14-13-30-15-9-11-16(12-10-15)32(24,28)29/h1-12H,13-14H2,(H2,24,28,29)