5-[2-chloranyl-6-[(3-iodanylphenyl)carbonylamino]purin-9-yl]-N-methyl-3,4-bis(oxidanyl)oxolane-2-carboxamide

Systemtic Name: 5-[2-chloranyl-6-[(3-iodanylphenyl)carbonylamino]purin-9-yl]-N-methyl-3,4-bis(oxidanyl)oxolane-2-carboxamide Openeye Name: 5-[2-chloro-6-[(3-iodobenzoyl)amino]purin-9-yl]-3,4-dihydroxy-N-methyl-tetrahydrofuran-2-carboxamide CAS Name: 5-[2-chloro-6-[[(3-iodophenyl)-oxomethyl]amino]-9-purinyl]-3,4-dihydroxy-N-methyl-2-oxolanecarboxamide IUPAC Name: 5-[2-chloro-6-[(3-iodobenzoyl)amino]purin-9-yl]-3,4-dihydroxy-N-methyloxolane-2-carboxamide Traditional Name: 5-[2-chloro-6-[(3-iodobenzoyl)amino]purin-9-yl]-3,4-dihydroxy-N-methyl-tetrahydrofuran-2-carboxamide Formula: C18H16ClIN6O5 MolecularWeight: 558.71431

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1C(C(C(O1)N2C=NC3=C2N=C(N=C3NC(=O)C4=CC(=CC=C4)I)Cl)O)O

Isomeric SMILES

CNC(=O)C1C(C(C(O1)N2C=NC3=C2N=C(N=C3NC(=O)C4=CC(=CC=C4)I)Cl)O)O

InChI

InChI=1S/C18H16ClIN6O5/c1-21-16(30)12-10(27)11(28)17(31-12)26-6-22-9-13(24-18(19)25-14(9)26)23-15(29)7-3-2-4-8(20)5-7/h2-6,10-12,17,27-28H,1H3,(H,21,30)(H,23,24,25,29)