N,N-dimethyl-3-[(7-nitro-4-oxidanylidene-quinazolin-3-yl)methyl]benzenesulfonamide

Systemtic Name: N,N-dimethyl-3-[(7-nitro-4-oxidanylidene-quinazolin-3-yl)methyl]benzenesulfonamide Openeye Name: N,N-dimethyl-3-[(7-nitro-4-oxo-quinazolin-3-yl)methyl]benzenesulfonamide CAS Name: N,N-dimethyl-3-[(7-nitro-4-oxo-3-quinazolinyl)methyl]benzenesulfonamide IUPAC Name: N,N-dimethyl-3-[(7-nitro-4-oxoquinazolin-3-yl)methyl]benzenesulfonamide Traditional Name: 3-[(4-keto-7-nitro-quinazolin-3-yl)methyl]-N,N-dimethyl-benzenesulfonamide Formula: C17H16N4O5S MolecularWeight: 388.39774

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)CN2C=NC3=C(C2=O)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)CN2C=NC3=C(C2=O)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O5S/c1-19(2)27(25,26)14-5-3-4-12(8-14)10-20-11-18-16-9-13(21(23)24)6-7-15(16)17(20)22/h3-9,11H,10H2,1-2H3