N-(2-methoxyphenyl)-5-[(3-nitropyridin-2-yl)amino]-2-pyrrolidin-1-yl-benzenesulfonamide

Systemtic Name: N-(2-methoxyphenyl)-5-[(3-nitropyridin-2-yl)amino]-2-pyrrolidin-1-yl-benzenesulfonamide Openeye Name: N-(2-methoxyphenyl)-5-[(3-nitro-2-pyridyl)amino]-2-pyrrolidin-1-yl-benzenesulfonamide CAS Name: N-(2-methoxyphenyl)-5-[(3-nitro-2-pyridinyl)amino]-2-(1-pyrrolidinyl)benzenesulfonamide IUPAC Name: N-(2-methoxyphenyl)-5-[(3-nitropyridin-2-yl)amino]-2-pyrrolidin-1-ylbenzenesulfonamide Traditional Name: N-(2-methoxyphenyl)-5-[(3-nitro-2-pyridyl)amino]-2-pyrrolidino-benzenesulfonamide Formula: C22H23N5O5S MolecularWeight: 469.51352

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NS(=O)(=O)C2=C(C=CC(=C2)NC3=C(C=CC=N3)[N+](=O)[O-])N4CCCC4

Isomeric SMILES

COC1=CC=CC=C1NS(=O)(=O)C2=C(C=CC(=C2)NC3=C(C=CC=N3)[N+](=O)[O-])N4CCCC4

InChI

InChI=1S/C22H23N5O5S/c1-32-20-9-3-2-7-17(20)25-33(30,31)21-15-16(10-11-18(21)26-13-4-5-14-26)24-22-19(27(28)29)8-6-12-23-22/h2-3,6-12,15,25H,4-5,13-14H2,1H3,(H,23,24)