ethyl 5-[[2-butyl-3-(3-carboxyoxy-2-methyl-4-phenyl-phenyl)imidazo[4,5-b]pyridin-5-yl]amino]pentanoate

Systemtic Name: ethyl 5-[[2-butyl-3-(3-carboxyoxy-2-methyl-4-phenyl-phenyl)imidazo[4,5-b]pyridin-5-yl]amino]pentanoate Openeye Name: ethyl 5-[[2-butyl-3-(3-carboxyoxy-2-methyl-4-phenyl-phenyl)imidazo[4,5-b]pyridin-5-yl]amino]pentanoate CAS Name: 5-[[2-butyl-3-(3-carboxyoxy-2-methyl-4-phenylphenyl)-5-imidazo[4,5-b]pyridinyl]amino]pentanoic acid ethyl ester IUPAC Name: ethyl 5-[[2-butyl-3-(3-carboxyoxy-2-methyl-4-phenylphenyl)imidazo[4,5-b]pyridin-5-yl]amino]pentanoate Traditional Name: 5-[[2-butyl-3-(3-carboxyoxy-2-methyl-4-phenyl-phenyl)imidazo[4,5-b]pyridin-5-yl]amino]valeric acid ethyl ester Formula: C31H36N4O5 MolecularWeight: 544.64134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)O)C)N=C(C=C2)NCCCCC(=O)OCC

Isomeric SMILES

CCCCC1=NC2=C(N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)O)C)N=C(C=C2)NCCCCC(=O)OCC

InChI

InChI=1S/C31H36N4O5/c1-4-6-14-27-33-24-17-19-26(32-20-11-10-15-28(36)39-5-2)34-30(24)35(27)25-18-16-23(22-12-8-7-9-13-22)29(21(25)3)40-31(37)38/h7-9,12-13,16-19H,4-6,10-11,14-15,20H2,1-3H3,(H,32,34)(H,37,38)