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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC(=C(N=C2N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)OC(C)(C)C)C)C)NC(=O)C(C)C

Isomeric SMILES

CCCCC1=NC2=CC(=C(N=C2N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)OC(C)(C)C)C)C)NC(=O)C(C)C

InChI

InChI=1S/C33H40N4O4/c1-9-10-16-28-35-26-19-25(36-31(38)20(2)3)22(5)34-30(26)37(28)27-18-17-24(23-14-12-11-13-15-23)29(21(27)4)40-32(39)41-33(6,7)8/h11-15,17-20H,9-10,16H2,1-8H3,(H,36,38)