N-[[3-[(4-ethylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[[3-[(4-ethylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]-4-nitro-benzenesulfonamide Openeye Name: N-[[3-[(4-ethylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]-4-nitro-benzenesulfonamide CAS Name: N-[[3-[(4-ethylphenyl)methyl]-2-imidazo[4,5-b]pyridinyl]methyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[[3-[(4-ethylphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]-4-nitrobenzenesulfonamide Traditional Name: N-[[3-(4-ethylbenzyl)imidazo[4,5-b]pyridin-2-yl]methyl]-4-nitro-benzenesulfonamide Formula: C22H21N5O4S MolecularWeight: 451.49824

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2C(=NC3=C2N=CC=C3)CNS(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)CN2C(=NC3=C2N=CC=C3)CNS(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H21N5O4S/c1-2-16-5-7-17(8-6-16)15-26-21(25-20-4-3-13-23-22(20)26)14-24-32(30,31)19-11-9-18(10-12-19)27(28)29/h3-13,24H,2,14-15H2,1H3