N,N-diethyl-4-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)oxy-3-nitro-benzenesulfonamide

Systemtic Name: N,N-diethyl-4-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)oxy-3-nitro-benzenesulfonamide Openeye Name: N,N-diethyl-4-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)oxy-3-nitro-benzenesulfonamide CAS Name: N,N-diethyl-4-[(2-methyl-5-pyrazolo[1,5-a]quinazolinyl)oxy]-3-nitrobenzenesulfonamide IUPAC Name: N,N-diethyl-4-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)oxy-3-nitrobenzenesulfonamide Traditional Name: N,N-diethyl-4-(2-methylpyrazolo[1,5-a]quinazolin-5-yl)oxy-3-nitro-benzenesulfonamide Formula: C21H21N5O5S MolecularWeight: 455.48694

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC2=NC3=CC(=NN3C4=CC=CC=C42)C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC2=NC3=CC(=NN3C4=CC=CC=C42)C)[N+](=O)[O-]

InChI

InChI=1S/C21H21N5O5S/c1-4-24(5-2)32(29,30)15-10-11-19(18(13-15)26(27)28)31-21-16-8-6-7-9-17(16)25-20(22-21)12-14(3)23-25/h6-13H,4-5H2,1-3H3