tert-butyl [3-[2-butyl-6-(dimethylcarbamoylamino)-5-methyl-imidazo[4,5-b]pyridin-1-yl]-2-methyl-6-phenyl-phenyl] carbonate

Systemtic Name: tert-butyl [3-[2-butyl-6-(dimethylcarbamoylamino)-5-methyl-imidazo[4,5-b]pyridin-1-yl]-2-methyl-6-phenyl-phenyl] carbonate Openeye Name: tert-butyl [3-[2-butyl-6-(dimethylcarbamoylamino)-5-methyl-imidazo[4,5-b]pyridin-1-yl]-2-methyl-6-phenyl-phenyl] carbonate CAS Name: carbonic acid tert-butyl [3-[2-butyl-6-[[dimethylamino(oxo)methyl]amino]-5-methyl-1-imidazo[4,5-b]pyridinyl]-2-methyl-6-phenylphenyl] ester IUPAC Name: tert-butyl [3-[2-butyl-6-(dimethylcarbamoylamino)-5-methylimidazo[4,5-b]pyridin-1-yl]-2-methyl-6-phenylphenyl] carbonate Traditional Name: carbonic acid tert-butyl [3-[2-butyl-6-(dimethylcarbamoylamino)-5-methyl-imidazo[4,5-b]pyridin-1-yl]-2-methyl-6-phenyl-phenyl] ester Formula: C32H39N5O4 MolecularWeight: 557.68316

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H39N5O4/c1-9-10-16-27-35-29-26(19-24(21(3)33-29)34-30(38)36(7)8)37(27)25-18-17-23(22-14-12-11-13-15-22)28(20(25)2)40-31(39)41-32(4,5)6/h11-15,17-19H,9-10,16H2,1-8H3,(H,34,38)