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

Systemtic Name: N-ethyl-4-methoxy-N-[3-(3-nitropyrazolo[1,5-a]pyrimidin-7-yl)phenyl]benzenesulfonamide Openeye Name: N-ethyl-4-methoxy-N-[3-(3-nitropyrazolo[1,5-a]pyrimidin-7-yl)phenyl]benzenesulfonamide CAS Name: N-ethyl-4-methoxy-N-[3-(3-nitro-7-pyrazolo[1,5-a]pyrimidinyl)phenyl]benzenesulfonamide IUPAC Name: N-ethyl-4-methoxy-N-[3-(3-nitropyrazolo[1,5-a]pyrimidin-7-yl)phenyl]benzenesulfonamide Traditional Name: N-ethyl-4-methoxy-N-[3-(3-nitropyrazolo[1,5-a]pyrimidin-7-yl)phenyl]benzenesulfonamide Formula: C21H19N5O5S MolecularWeight: 453.47106

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCN(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/C21H19N5O5S/c1-3-24(32(29,30)18-9-7-17(31-2)8-10-18)16-6-4-5-15(13-16)19-11-12-22-21-20(26(27)28)14-23-25(19)21/h4-14H,3H2,1-2H3