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

Systemtic Name: 3-[[3-(tert-butylamino)-2-thiophen-2-yl-imidazo[1,2-a]pyridin-8-yl]carbonylamino]-3-cyclohexyl-propanoic acid Openeye Name: 3-[[3-(tert-butylamino)-2-(2-thienyl)imidazo[1,2-a]pyridine-8-carbonyl]amino]-3-cyclohexyl-propanoic acid CAS Name: 3-[[[3-(tert-butylamino)-2-thiophen-2-yl-8-imidazo[1,2-a]pyridinyl]-oxomethyl]amino]-3-cyclohexylpropanoic acid IUPAC Name: 3-[[3-(tert-butylamino)-2-thiophen-2-ylimidazo[1,2-a]pyridine-8-carbonyl]amino]-3-cyclohexylpropanoic acid Traditional Name: 3-[[3-(tert-butylamino)-2-(2-thienyl)imidazo[1,2-a]pyridine-8-carbonyl]amino]-3-cyclohexyl-propionic acid Formula: C25H32N4O3S MolecularWeight: 468.61158

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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)C4=CC=CS4

Isomeric SMILES

CC(C)(C)NC1=C(N=C2N1C=CC=C2C(=O)NC(CC(=O)O)C3CCCCC3)C4=CC=CS4

InChI

InChI=1S/C25H32N4O3S/c1-25(2,3)28-23-21(19-12-8-14-33-19)27-22-17(11-7-13-29(22)23)24(32)26-18(15-20(30)31)16-9-5-4-6-10-16/h7-8,11-14,16,18,28H,4-6,9-10,15H2,1-3H3,(H,26,32)(H,30,31)