tert-butyl N-[3-[(4-bromophenyl)methyl]-2-butyl-5-methyl-imidazo[4,5-b]pyridin-6-yl]carbamate

Systemtic Name: tert-butyl N-[3-[(4-bromophenyl)methyl]-2-butyl-5-methyl-imidazo[4,5-b]pyridin-6-yl]carbamate Openeye Name: tert-butyl N-[3-[(4-bromophenyl)methyl]-2-butyl-5-methyl-imidazo[4,5-b]pyridin-6-yl]carbamate CAS Name: N-[3-[(4-bromophenyl)methyl]-2-butyl-5-methyl-6-imidazo[4,5-b]pyridinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[(4-bromophenyl)methyl]-2-butyl-5-methylimidazo[4,5-b]pyridin-6-yl]carbamate Traditional Name: N-[3-(4-bromobenzyl)-2-butyl-5-methyl-imidazo[4,5-b]pyridin-6-yl]carbamic acid tert-butyl ester Formula: C23H29BrN4O2 MolecularWeight: 473.40596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC(=C(N=C2N1CC3=CC=C(C=C3)Br)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCC1=NC2=CC(=C(N=C2N1CC3=CC=C(C=C3)Br)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C23H29BrN4O2/c1-6-7-8-20-26-19-13-18(27-22(29)30-23(3,4)5)15(2)25-21(19)28(20)14-16-9-11-17(24)12-10-16/h9-13H,6-8,14H2,1-5H3,(H,27,29)