N-[2-methoxy-4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)phenyl]-4-methyl-3,5-dinitro-benzenesulfonamide

Systemtic Name: N-[2-methoxy-4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)phenyl]-4-methyl-3,5-dinitro-benzenesulfonamide Openeye Name: N-[2-methoxy-4-(2-methyl-4-oxo-quinazolin-3-yl)phenyl]-4-methyl-3,5-dinitro-benzenesulfonamide CAS Name: N-[2-methoxy-4-(2-methyl-4-oxo-3-quinazolinyl)phenyl]-4-methyl-3,5-dinitrobenzenesulfonamide IUPAC Name: N-[2-methoxy-4-(2-methyl-4-oxoquinazolin-3-yl)phenyl]-4-methyl-3,5-dinitrobenzenesulfonamide Traditional Name: N-[4-(4-keto-2-methyl-quinazolin-3-yl)-2-methoxy-phenyl]-4-methyl-3,5-dinitro-benzenesulfonamide Formula: C23H19N5O8S MolecularWeight: 525.49066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)NC2=C(C=C(C=C2)N3C(=NC4=CC=CC=C4C3=O)C)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)NC2=C(C=C(C=C2)N3C(=NC4=CC=CC=C4C3=O)C)OC)[N+](=O)[O-]

InChI

InChI=1S/C23H19N5O8S/c1-13-20(27(30)31)11-16(12-21(13)28(32)33)37(34,35)25-19-9-8-15(10-22(19)36-3)26-14(2)24-18-7-5-4-6-17(18)23(26)29/h4-12,25H,1-3H3