4-methoxy-N-methyl-N-[3-(3-nitropyrazolo[1,5-a]pyrimidin-7-yl)phenyl]benzenesulfonamide

Systemtic Name: 4-methoxy-N-methyl-N-[3-(3-nitropyrazolo[1,5-a]pyrimidin-7-yl)phenyl]benzenesulfonamide Openeye Name: 4-methoxy-N-methyl-N-[3-(3-nitropyrazolo[1,5-a]pyrimidin-7-yl)phenyl]benzenesulfonamide CAS Name: 4-methoxy-N-methyl-N-[3-(3-nitro-7-pyrazolo[1,5-a]pyrimidinyl)phenyl]benzenesulfonamide IUPAC Name: 4-methoxy-N-methyl-N-[3-(3-nitropyrazolo[1,5-a]pyrimidin-7-yl)phenyl]benzenesulfonamide Traditional Name: 4-methoxy-N-methyl-N-[3-(3-nitropyrazolo[1,5-a]pyrimidin-7-yl)phenyl]benzenesulfonamide Formula: C20H17N5O5S MolecularWeight: 439.44448

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC(=C1)C2=CC=NC3=C(C=NN23)[N+](=O)[O-])S(=O)(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CN(C1=CC=CC(=C1)C2=CC=NC3=C(C=NN23)[N+](=O)[O-])S(=O)(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C20H17N5O5S/c1-23(31(28,29)17-8-6-16(30-2)7-9-17)15-5-3-4-14(12-15)18-10-11-21-20-19(25(26)27)13-22-24(18)20/h3-13H,1-2H3