N,N-dimethyl-4-[2-[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanylethoxy]benzenesulfonamide

Systemtic Name: N,N-dimethyl-4-[2-[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanylethoxy]benzenesulfonamide Openeye Name: 4-[2-[3-(3-hydroxypropyl)-4-oxo-quinazolin-2-yl]sulfanylethoxy]-N,N-dimethyl-benzenesulfonamide CAS Name: 4-[2-[[3-(3-hydroxypropyl)-4-oxo-2-quinazolinyl]thio]ethoxy]-N,N-dimethylbenzenesulfonamide IUPAC Name: 4-[2-[3-(3-hydroxypropyl)-4-oxoquinazolin-2-yl]sulfanylethoxy]-N,N-dimethylbenzenesulfonamide Traditional Name: 4-[2-[[3-(3-hydroxypropyl)-4-keto-quinazolin-2-yl]thio]ethoxy]-N,N-dimethyl-benzenesulfonamide Formula: C21H25N3O5S2 MolecularWeight: 463.5703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)OCCSC2=NC3=CC=CC=C3C(=O)N2CCCO

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)OCCSC2=NC3=CC=CC=C3C(=O)N2CCCO

InChI

InChI=1S/C21H25N3O5S2/c1-23(2)31(27,28)17-10-8-16(9-11-17)29-14-15-30-21-22-19-7-4-3-6-18(19)20(26)24(21)12-5-13-25/h3-4,6-11,25H,5,12-15H2,1-2H3