N-[3-(4-methoxyphenyl)-2-methyl-4-oxidanylidene-quinazolin-6-yl]-2-nitro-benzenesulfonamide

Systemtic Name: N-[3-(4-methoxyphenyl)-2-methyl-4-oxidanylidene-quinazolin-6-yl]-2-nitro-benzenesulfonamide Openeye Name: N-[3-(4-methoxyphenyl)-2-methyl-4-oxo-quinazolin-6-yl]-2-nitro-benzenesulfonamide CAS Name: N-[3-(4-methoxyphenyl)-2-methyl-4-oxo-6-quinazolinyl]-2-nitrobenzenesulfonamide IUPAC Name: N-[3-(4-methoxyphenyl)-2-methyl-4-oxoquinazolin-6-yl]-2-nitrobenzenesulfonamide Traditional Name: N-[4-keto-3-(4-methoxyphenyl)-2-methyl-quinazolin-6-yl]-2-nitro-benzenesulfonamide Formula: C22H18N4O6S MolecularWeight: 466.46652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)NS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-])C(=O)N1C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)NS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-])C(=O)N1C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H18N4O6S/c1-14-23-19-12-7-15(24-33(30,31)21-6-4-3-5-20(21)26(28)29)13-18(19)22(27)25(14)16-8-10-17(32-2)11-9-16/h3-13,24H,1-2H3