diethyl 2-[[4-[(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl]-phenyl-methyl]-2-(phenylmethyl)propanedioate

Systemtic Name: diethyl 2-[[4-[(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl]-phenyl-methyl]-2-(phenylmethyl)propanedioate Openeye Name: diethyl 2-benzyl-2-[[4-[(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl]-phenyl-methyl]propanedioate CAS Name: 2-[[4-[(2-ethyl-5,7-dimethyl-3-imidazo[4,5-b]pyridinyl)methyl]phenyl]-phenylmethyl]-2-(phenylmethyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-benzyl-2-[[4-[(2-ethyl-5,7-dimethylimidazo[4,5-b]pyridin-3-yl)methyl]phenyl]-phenylmethyl]propanedioate Traditional Name: 2-benzyl-2-[[4-[(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)methyl]phenyl]-phenyl-methyl]malonic acid diethyl ester Formula: C38H41N3O4 MolecularWeight: 603.74984

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1CC3=CC=C(C=C3)C(C4=CC=CC=C4)C(CC5=CC=CC=C5)(C(=O)OCC)C(=O)OCC)N=C(C=C2C)C

Isomeric SMILES

CCC1=NC2=C(N1CC3=CC=C(C=C3)C(C4=CC=CC=C4)C(CC5=CC=CC=C5)(C(=O)OCC)C(=O)OCC)N=C(C=C2C)C

InChI

InChI=1S/C38H41N3O4/c1-6-32-40-34-26(4)23-27(5)39-35(34)41(32)25-29-19-21-31(22-20-29)33(30-17-13-10-14-18-30)38(36(42)44-7-2,37(43)45-8-3)24-28-15-11-9-12-16-28/h9-23,33H,6-8,24-25H2,1-5H3