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

Systemtic Name: 3-cyclohexyl-3-[[3-(cyclohexylamino)-2-thiophen-2-yl-imidazo[1,2-a]pyridin-8-yl]carbonylamino]propanoic acid Openeye Name: 3-cyclohexyl-3-[[3-(cyclohexylamino)-2-(2-thienyl)imidazo[1,2-a]pyridine-8-carbonyl]amino]propanoic acid CAS Name: 3-cyclohexyl-3-[[[3-(cyclohexylamino)-2-thiophen-2-yl-8-imidazo[1,2-a]pyridinyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-cyclohexyl-3-[[3-(cyclohexylamino)-2-thiophen-2-ylimidazo[1,2-a]pyridine-8-carbonyl]amino]propanoic acid Traditional Name: 3-cyclohexyl-3-[[3-(cyclohexylamino)-2-(2-thienyl)imidazo[1,2-a]pyridine-8-carbonyl]amino]propionic acid Formula: C27H34N4O3S MolecularWeight: 494.64886

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(CC(=O)O)NC(=O)C2=CC=CN3C2=NC(=C3NC4CCCCC4)C5=CC=CS5

Isomeric SMILES

C1CCC(CC1)C(CC(=O)O)NC(=O)C2=CC=CN3C2=NC(=C3NC4CCCCC4)C5=CC=CS5

InChI

InChI=1S/C27H34N4O3S/c32-23(33)17-21(18-9-3-1-4-10-18)29-27(34)20-13-7-15-31-25(20)30-24(22-14-8-16-35-22)26(31)28-19-11-5-2-6-12-19/h7-8,13-16,18-19,21,28H,1-6,9-12,17H2,(H,29,34)(H,32,33)