N,N-diethyl-3-nitro-4-[4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydro-2H-pyridin-1-yl]benzenesulfonamide

Systemtic Name: N,N-diethyl-3-nitro-4-[4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydro-2H-pyridin-1-yl]benzenesulfonamide Openeye Name: N,N-diethyl-3-nitro-4-[4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydro-2H-pyridin-1-yl]benzenesulfonamide CAS Name: N,N-diethyl-3-nitro-4-[4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydro-2H-pyridin-1-yl]benzenesulfonamide IUPAC Name: N,N-diethyl-3-nitro-4-[4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydro-2H-pyridin-1-yl]benzenesulfonamide Traditional Name: N,N-diethyl-3-nitro-4-[4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydro-2H-pyridin-1-yl]benzenesulfonamide Formula: C22H25N5O4S MolecularWeight: 455.53

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCC(=CC2)C3=CNC4=C3C=CC=N4)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCC(=CC2)C3=CNC4=C3C=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C22H25N5O4S/c1-3-26(4-2)32(30,31)17-7-8-20(21(14-17)27(28)29)25-12-9-16(10-13-25)19-15-24-22-18(19)6-5-11-23-22/h5-9,11,14-15H,3-4,10,12-13H2,1-2H3,(H,23,24)