[3-[2-ethyl-5-(propanoylamino)imidazo[4,5-b]pyridin-3-yl]-2-methyl-6-phenyl-phenyl] hydrogen carbonate

Systemtic Name: [3-[2-ethyl-5-(propanoylamino)imidazo[4,5-b]pyridin-3-yl]-2-methyl-6-phenyl-phenyl] hydrogen carbonate Openeye Name: [3-[2-ethyl-5-(propanoylamino)imidazo[4,5-b]pyridin-3-yl]-2-methyl-6-phenyl-phenyl] hydrogen carbonate CAS Name: carbonic acid [3-[2-ethyl-5-(1-oxopropylamino)-3-imidazo[4,5-b]pyridinyl]-2-methyl-6-phenylphenyl] ester IUPAC Name: [3-[2-ethyl-5-(propanoylamino)imidazo[4,5-b]pyridin-3-yl]-2-methyl-6-phenylphenyl] hydrogen carbonate Traditional Name: carbonic acid [3-(2-ethyl-5-propionamido-imidazo[4,5-b]pyridin-3-yl)-2-methyl-6-phenyl-phenyl] ester Formula: C25H24N4O4 MolecularWeight: 444.48246

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)O)C)N=C(C=C2)NC(=O)CC

Isomeric SMILES

CCC1=NC2=C(N1C3=C(C(=C(C=C3)C4=CC=CC=C4)OC(=O)O)C)N=C(C=C2)NC(=O)CC

InChI

InChI=1S/C25H24N4O4/c1-4-21-26-18-12-14-20(27-22(30)5-2)28-24(18)29(21)19-13-11-17(16-9-7-6-8-10-16)23(15(19)3)33-25(31)32/h6-14H,4-5H2,1-3H3,(H,31,32)(H,27,28,30)