3-(aminocarbonylamino)-5-[6-[(3-iodanylphenyl)amino]purin-9-yl]-N-methyl-4-oxidanyl-oxolane-2-carboxamide

Systemtic Name: 3-(aminocarbonylamino)-5-[6-[(3-iodanylphenyl)amino]purin-9-yl]-N-methyl-4-oxidanyl-oxolane-2-carboxamide Openeye Name: 4-hydroxy-5-[6-(3-iodoanilino)purin-9-yl]-N-methyl-3-ureido-tetrahydrofuran-2-carboxamide CAS Name: 3-(carbamoylamino)-4-hydroxy-5-[6-(3-iodoanilino)-9-purinyl]-N-methyl-2-oxolanecarboxamide IUPAC Name: 3-(carbamoylamino)-4-hydroxy-5-[6-(3-iodoanilino)purin-9-yl]-N-methyloxolane-2-carboxamide Traditional Name: 4-hydroxy-5-[6-(3-iodoanilino)purin-9-yl]-N-methyl-3-ureido-tetrahydrofuran-2-carboxamide Formula: C18H19IN8O4 MolecularWeight: 538.29913

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1C(C(C(O1)N2C=NC3=C2N=CN=C3NC4=CC(=CC=C4)I)O)NC(=O)N

Isomeric SMILES

CNC(=O)C1C(C(C(O1)N2C=NC3=C2N=CN=C3NC4=CC(=CC=C4)I)O)NC(=O)N

InChI

InChI=1S/C18H19IN8O4/c1-21-16(29)13-10(26-18(20)30)12(28)17(31-13)27-7-24-11-14(22-6-23-15(11)27)25-9-4-2-3-8(19)5-9/h2-7,10,12-13,17,28H,1H3,(H,21,29)(H3,20,26,30)(H,22,23,25)