tert-butyl [2-methyl-3-[5-(2-methylpentanoylamino)-2-propyl-imidazo[4,5-b]pyridin-3-yl]-6-phenyl-phenyl] carbonate

Systemtic Name: tert-butyl [2-methyl-3-[5-(2-methylpentanoylamino)-2-propyl-imidazo[4,5-b]pyridin-3-yl]-6-phenyl-phenyl] carbonate Openeye Name: tert-butyl [2-methyl-3-[5-(2-methylpentanoylamino)-2-propyl-imidazo[4,5-b]pyridin-3-yl]-6-phenyl-phenyl] carbonate CAS Name: carbonic acid tert-butyl [2-methyl-3-[5-[(2-methyl-1-oxopentyl)amino]-2-propyl-3-imidazo[4,5-b]pyridinyl]-6-phenylphenyl] ester IUPAC Name: tert-butyl [2-methyl-3-[5-(2-methylpentanoylamino)-2-propylimidazo[4,5-b]pyridin-3-yl]-6-phenylphenyl] carbonate Traditional Name: carbonic acid tert-butyl [2-methyl-3-[5-(2-methylpentanoylamino)-2-propyl-imidazo[4,5-b]pyridin-3-yl]-6-phenyl-phenyl] ester Formula: C33H40N4O4 MolecularWeight: 556.6951

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)OC(C)(C)C)C)N=C(C=C2)NC(=O)C(C)CCC

Isomeric SMILES

CCCC1=NC2=C(N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)OC(C)(C)C)C)N=C(C=C2)NC(=O)C(C)CCC

InChI

InChI=1S/C33H40N4O4/c1-8-13-21(3)31(38)36-27-20-18-25-30(35-27)37(28(34-25)14-9-2)26-19-17-24(23-15-11-10-12-16-23)29(22(26)4)40-32(39)41-33(5,6)7/h10-12,15-21H,8-9,13-14H2,1-7H3,(H,35,36,38)