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

Systemtic Name: 3-[[3-(tert-butylamino)-2-phenethyl-imidazo[1,2-a]pyridin-8-yl]carbonylamino]-3-cyclohexyl-propanoic acid Openeye Name: 3-[[3-(tert-butylamino)-2-phenethyl-imidazo[1,2-a]pyridine-8-carbonyl]amino]-3-cyclohexyl-propanoic acid CAS Name: 3-[[[3-(tert-butylamino)-2-phenethyl-8-imidazo[1,2-a]pyridinyl]-oxomethyl]amino]-3-cyclohexylpropanoic acid IUPAC Name: 3-[[3-(tert-butylamino)-2-phenethylimidazo[1,2-a]pyridine-8-carbonyl]amino]-3-cyclohexylpropanoic acid Traditional Name: 3-[[3-(tert-butylamino)-2-phenethyl-imidazo[1,2-a]pyridine-8-carbonyl]amino]-3-cyclohexyl-propionic acid Formula: C29H38N4O3 MolecularWeight: 490.63702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=C(N=C2N1C=CC=C2C(=O)NC(CC(=O)O)C3CCCCC3)CCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)NC1=C(N=C2N1C=CC=C2C(=O)NC(CC(=O)O)C3CCCCC3)CCC4=CC=CC=C4

InChI

InChI=1S/C29H38N4O3/c1-29(2,3)32-27-23(17-16-20-11-6-4-7-12-20)30-26-22(15-10-18-33(26)27)28(36)31-24(19-25(34)35)21-13-8-5-9-14-21/h4,6-7,10-12,15,18,21,24,32H,5,8-9,13-14,16-17,19H2,1-3H3,(H,31,36)(H,34,35)