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

Systemtic Name: tert-butyl [2-[[2-butyl-6-[butyl(ethanoyl)amino]-5-methyl-imidazo[4,5-b]pyridin-3-yl]methyl]-6-phenyl-phenyl] carbonate Openeye Name: [2-[[6-[acetyl(butyl)amino]-2-butyl-5-methyl-imidazo[4,5-b]pyridin-3-yl]methyl]-6-phenyl-phenyl] tert-butyl carbonate CAS Name: carbonic acid [2-[[6-[acetyl(butyl)amino]-2-butyl-5-methyl-3-imidazo[4,5-b]pyridinyl]methyl]-6-phenylphenyl] tert-butyl ester IUPAC Name: [2-[[6-[acetyl(butyl)amino]-2-butyl-5-methylimidazo[4,5-b]pyridin-3-yl]methyl]-6-phenylphenyl] tert-butyl carbonate Traditional Name: carbonic acid [2-[[6-[acetyl(butyl)amino]-2-butyl-5-methyl-imidazo[4,5-b]pyridin-3-yl]methyl]-6-phenyl-phenyl] tert-butyl ester Formula: C35H44N4O4 MolecularWeight: 584.74826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC(=C(N=C2N1CC3=CC=CC(=C3OC(=O)OC(C)(C)C)C4=CC=CC=C4)C)N(CCCC)C(=O)C

Isomeric SMILES

CCCCC1=NC2=CC(=C(N=C2N1CC3=CC=CC(=C3OC(=O)OC(C)(C)C)C4=CC=CC=C4)C)N(CCCC)C(=O)C

InChI

InChI=1S/C35H44N4O4/c1-8-10-20-31-37-29-22-30(38(25(4)40)21-11-9-2)24(3)36-33(29)39(31)23-27-18-15-19-28(26-16-13-12-14-17-26)32(27)42-34(41)43-35(5,6)7/h12-19,22H,8-11,20-21,23H2,1-7H3