3-cyclohexyl-3-[[3-(cyclohexylamino)-2-phenethyl-imidazo[1,2-a]pyridin-8-yl]carbonylamino]propanoic acid

Systemtic Name: 3-cyclohexyl-3-[[3-(cyclohexylamino)-2-phenethyl-imidazo[1,2-a]pyridin-8-yl]carbonylamino]propanoic acid Openeye Name: 3-cyclohexyl-3-[[3-(cyclohexylamino)-2-phenethyl-imidazo[1,2-a]pyridine-8-carbonyl]amino]propanoic acid CAS Name: 3-cyclohexyl-3-[[[3-(cyclohexylamino)-2-phenethyl-8-imidazo[1,2-a]pyridinyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-cyclohexyl-3-[[3-(cyclohexylamino)-2-phenethylimidazo[1,2-a]pyridine-8-carbonyl]amino]propanoic acid Traditional Name: 3-cyclohexyl-3-[[3-(cyclohexylamino)-2-phenethyl-imidazo[1,2-a]pyridine-8-carbonyl]amino]propionic acid Formula: C31H40N4O3 MolecularWeight: 516.6743

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(CC(=O)O)NC(=O)C2=CC=CN3C2=NC(=C3NC4CCCCC4)CCC5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)C(CC(=O)O)NC(=O)C2=CC=CN3C2=NC(=C3NC4CCCCC4)CCC5=CC=CC=C5

InChI

InChI=1S/C31H40N4O3/c36-28(37)21-27(23-13-6-2-7-14-23)34-31(38)25-17-10-20-35-29(25)33-26(19-18-22-11-4-1-5-12-22)30(35)32-24-15-8-3-9-16-24/h1,4-5,10-12,17,20,23-24,27,32H,2-3,6-9,13-16,18-19,21H2,(H,34,38)(H,36,37)