[2-[[2-butyl-5-[(phenylmethyl)sulfonylamino]imidazo[4,5-b]pyridin-3-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate

Systemtic Name: [2-[[2-butyl-5-[(phenylmethyl)sulfonylamino]imidazo[4,5-b]pyridin-3-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate Openeye Name: [2-[[5-(benzylsulfonylamino)-2-butyl-imidazo[4,5-b]pyridin-3-yl]methyl]-6-phenyl-phenyl] hydrogen carbonate CAS Name: carbonic acid [2-[[2-butyl-5-[(phenylmethyl)sulfonylamino]-3-imidazo[4,5-b]pyridinyl]methyl]-6-phenylphenyl] ester IUPAC Name: [2-[[5-(benzylsulfonylamino)-2-butylimidazo[4,5-b]pyridin-3-yl]methyl]-6-phenylphenyl] hydrogen carbonate Traditional Name: carbonic acid [2-[[5-(benzylsulfonylamino)-2-butyl-imidazo[4,5-b]pyridin-3-yl]methyl]-6-phenyl-phenyl] ester Formula: C31H30N4O5S MolecularWeight: 570.6587

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC=CC(=C3OC(=O)O)C4=CC=CC=C4)N=C(C=C2)NS(=O)(=O)CC5=CC=CC=C5

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=CC(=C3OC(=O)O)C4=CC=CC=C4)N=C(C=C2)NS(=O)(=O)CC5=CC=CC=C5

InChI

InChI=1S/C31H30N4O5S/c1-2-3-17-28-32-26-18-19-27(34-41(38,39)21-22-11-6-4-7-12-22)33-30(26)35(28)20-24-15-10-16-25(29(24)40-31(36)37)23-13-8-5-9-14-23/h4-16,18-19H,2-3,17,20-21H2,1H3,(H,33,34)(H,36,37)