ethyl 4-[6-methyl-3-[(3-methylbutanoylamino)methyl]imidazo[1,2-a]pyridin-2-yl]benzoate

Systemtic Name: ethyl 4-[6-methyl-3-[(3-methylbutanoylamino)methyl]imidazo[1,2-a]pyridin-2-yl]benzoate Openeye Name: ethyl 4-[6-methyl-3-[(3-methylbutanoylamino)methyl]imidazo[1,2-a]pyridin-2-yl]benzoate CAS Name: 4-[6-methyl-3-[[(3-methyl-1-oxobutyl)amino]methyl]-2-imidazo[1,2-a]pyridinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[6-methyl-3-[(3-methylbutanoylamino)methyl]imidazo[1,2-a]pyridin-2-yl]benzoate Traditional Name: 4-[3-[(isovalerylamino)methyl]-6-methyl-imidazo[1,2-a]pyridin-2-yl]benzoic acid ethyl ester Formula: C23H27N3O3 MolecularWeight: 393.47878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=C(N3C=C(C=CC3=N2)C)CNC(=O)CC(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=C(N3C=C(C=CC3=N2)C)CNC(=O)CC(C)C

InChI

InChI=1S/C23H27N3O3/c1-5-29-23(28)18-9-7-17(8-10-18)22-19(13-24-21(27)12-15(2)3)26-14-16(4)6-11-20(26)25-22/h6-11,14-15H,5,12-13H2,1-4H3,(H,24,27)