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

Systemtic Name: N-[[3-[(2-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]-3-nitro-benzenesulfonamide Openeye Name: N-[[3-[(2-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]-3-nitro-benzenesulfonamide CAS Name: N-[[3-[(2-methoxyphenyl)methyl]-2-imidazo[4,5-b]pyridinyl]methyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[[3-[(2-methoxyphenyl)methyl]imidazo[4,5-b]pyridin-2-yl]methyl]-3-nitrobenzenesulfonamide Traditional Name: 3-nitro-N-[(3-o-anisylimidazo[4,5-b]pyridin-2-yl)methyl]benzenesulfonamide Formula: C21H19N5O5S MolecularWeight: 453.47106

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN2C(=NC3=C2N=CC=C3)CNS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1CN2C(=NC3=C2N=CC=C3)CNS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H19N5O5S/c1-31-19-10-3-2-6-15(19)14-25-20(24-18-9-5-11-22-21(18)25)13-23-32(29,30)17-8-4-7-16(12-17)26(27)28/h2-12,23H,13-14H2,1H3