ethyl 3-[2,4-bis(fluoranyl)phenyl]-3-[4-[(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl]propanoate

Systemtic Name: ethyl 3-[2,4-bis(fluoranyl)phenyl]-3-[4-[(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl]propanoate Openeye Name: ethyl 3-(2,4-difluorophenyl)-3-[4-[(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl]propanoate CAS Name: 3-(2,4-difluorophenyl)-3-[4-[(2-ethyl-5,7-dimethyl-3-imidazo[4,5-b]pyridinyl)methyl]phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-(2,4-difluorophenyl)-3-[4-[(2-ethyl-5,7-dimethylimidazo[4,5-b]pyridin-3-yl)methyl]phenyl]propanoate Traditional Name: 3-(2,4-difluorophenyl)-3-[4-[(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl]propionic acid ethyl ester Formula: C28H29F2N3O2 MolecularWeight: 477.545566

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1CC3=CC=C(C=C3)C(CC(=O)OCC)C4=C(C=C(C=C4)F)F)N=C(C=C2C)C

Isomeric SMILES

CCC1=NC2=C(N1CC3=CC=C(C=C3)C(CC(=O)OCC)C4=C(C=C(C=C4)F)F)N=C(C=C2C)C

InChI

InChI=1S/C28H29F2N3O2/c1-5-25-32-27-17(3)13-18(4)31-28(27)33(25)16-19-7-9-20(10-8-19)23(15-26(34)35-6-2)22-12-11-21(29)14-24(22)30/h7-14,23H,5-6,15-16H2,1-4H3