4-[3-(3-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-methyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[3-(3-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-[3-(3-methoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-methyl-3-nitro-benzenesulfonamide CAS Name: 4-[[3-(3-methoxyphenyl)-4-oxo-2-quinazolinyl]thio]-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[3-(3-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-[[4-keto-3-(3-methoxyphenyl)quinazolin-2-yl]thio]-N-methyl-3-nitro-benzenesulfonamide Formula: C22H18N4O6S2 MolecularWeight: 498.53152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)SC2=NC3=CC=CC=C3C(=O)N2C4=CC(=CC=C4)OC)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)SC2=NC3=CC=CC=C3C(=O)N2C4=CC(=CC=C4)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H18N4O6S2/c1-23-34(30,31)16-10-11-20(19(13-16)26(28)29)33-22-24-18-9-4-3-8-17(18)21(27)25(22)14-6-5-7-15(12-14)32-2/h3-13,23H,1-2H3