2-[[3-(tert-butylamino)-2-cyclohex-3-en-1-yl-imidazo[1,2-a]pyridin-7-yl]carbonylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[3-(tert-butylamino)-2-cyclohex-3-en-1-yl-imidazo[1,2-a]pyridin-7-yl]carbonylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[3-(tert-butylamino)-2-cyclohex-3-en-1-yl-imidazo[1,2-a]pyridine-7-carbonyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[[3-(tert-butylamino)-2-(1-cyclohex-3-enyl)-7-imidazo[1,2-a]pyridinyl]-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[3-(tert-butylamino)-2-cyclohex-3-en-1-ylimidazo[1,2-a]pyridine-7-carbonyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[3-(tert-butylamino)-2-cyclohex-3-en-1-yl-imidazo[1,2-a]pyridine-7-carbonyl]amino]-3-phenyl-propionic acid Formula: C27H32N4O3 MolecularWeight: 460.56798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=C(N=C2N1C=CC(=C2)C(=O)NC(CC3=CC=CC=C3)C(=O)O)C4CCC=CC4

Isomeric SMILES

CC(C)(C)NC1=C(N=C2N1C=CC(=C2)C(=O)NC(CC3=CC=CC=C3)C(=O)O)C4CCC=CC4

InChI

InChI=1S/C27H32N4O3/c1-27(2,3)30-24-23(19-12-8-5-9-13-19)29-22-17-20(14-15-31(22)24)25(32)28-21(26(33)34)16-18-10-6-4-7-11-18/h4-8,10-11,14-15,17,19,21,30H,9,12-13,16H2,1-3H3,(H,28,32)(H,33,34)