3-(3-iodanyl-4-oxidanyl-phenyl)-2-[2-(3-oxidanylpropanoylamino)imidazo[4,5-b]pyridin-3-yl]propanamide

Systemtic Name: 3-(3-iodanyl-4-oxidanyl-phenyl)-2-[2-(3-oxidanylpropanoylamino)imidazo[4,5-b]pyridin-3-yl]propanamide Openeye Name: 3-(4-hydroxy-3-iodo-phenyl)-2-[2-(3-hydroxypropanoylamino)imidazo[4,5-b]pyridin-3-yl]propanamide CAS Name: 3-(4-hydroxy-3-iodophenyl)-2-[2-[(3-hydroxy-1-oxopropyl)amino]-3-imidazo[4,5-b]pyridinyl]propanamide IUPAC Name: 3-(4-hydroxy-3-iodophenyl)-2-[2-(3-hydroxypropanoylamino)imidazo[4,5-b]pyridin-3-yl]propanamide Traditional Name: 3-(4-hydroxy-3-iodo-phenyl)-2-[2-(3-hydroxypropanoylamino)imidazo[4,5-b]pyridin-3-yl]propionamide Formula: C18H18IN5O4 MolecularWeight: 495.27109

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(N=C1)N(C(=N2)NC(=O)CCO)C(CC3=CC(=C(C=C3)O)I)C(=O)N

Isomeric SMILES

C1=CC2=C(N=C1)N(C(=N2)NC(=O)CCO)C(CC3=CC(=C(C=C3)O)I)C(=O)N

InChI

InChI=1S/C18H18IN5O4/c19-11-8-10(3-4-14(11)26)9-13(16(20)28)24-17-12(2-1-6-21-17)22-18(24)23-15(27)5-7-25/h1-4,6,8,13,25-26H,5,7,9H2,(H2,20,28)(H,22,23,27)