3-[[3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 3-[[3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylmethyl]-N,N-dimethyl-benzenesulfonamide Openeye Name: 3-[[3-(2-furylmethyl)-4-oxo-quinazolin-2-yl]sulfanylmethyl]-N,N-dimethyl-benzenesulfonamide CAS Name: 3-[[[3-(2-furanylmethyl)-4-oxo-2-quinazolinyl]thio]methyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 3-[[3-(furan-2-ylmethyl)-4-oxoquinazolin-2-yl]sulfanylmethyl]-N,N-dimethylbenzenesulfonamide Traditional Name: 3-[[[3-(2-furfuryl)-4-keto-quinazolin-2-yl]thio]methyl]-N,N-dimethyl-benzenesulfonamide Formula: C22H21N3O4S2 MolecularWeight: 455.54984

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CO4

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CO4

InChI

InChI=1S/C22H21N3O4S2/c1-24(2)31(27,28)18-9-5-7-16(13-18)15-30-22-23-20-11-4-3-10-19(20)21(26)25(22)14-17-8-6-12-29-17/h3-13H,14-15H2,1-2H3