N-ethyl-3,4-bis(oxidanyl)-5-[6-(1,3,4-thiadiazol-2-ylcarbamoylamino)purin-9-yl]oxolane-2-carboxamide

Systemtic Name: N-ethyl-3,4-bis(oxidanyl)-5-[6-(1,3,4-thiadiazol-2-ylcarbamoylamino)purin-9-yl]oxolane-2-carboxamide Openeye Name: N-ethyl-3,4-dihydroxy-5-[6-(1,3,4-thiadiazol-2-ylcarbamoylamino)purin-9-yl]tetrahydrofuran-2-carboxamide CAS Name: N-ethyl-3,4-dihydroxy-5-[6-[[oxo-(1,3,4-thiadiazol-2-ylamino)methyl]amino]-9-purinyl]-2-oxolanecarboxamide IUPAC Name: N-ethyl-3,4-dihydroxy-5-[6-(1,3,4-thiadiazol-2-ylcarbamoylamino)purin-9-yl]oxolane-2-carboxamide Traditional Name: N-ethyl-3,4-dihydroxy-5-[6-(1,3,4-thiadiazol-2-ylcarbamoylamino)purin-9-yl]tetrahydrofuran-2-carboxamide Formula: C15H17N9O5S MolecularWeight: 435.41778

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1C(C(C(O1)N2C=NC3=C2N=CN=C3NC(=O)NC4=NN=CS4)O)O

Isomeric SMILES

CCNC(=O)C1C(C(C(O1)N2C=NC3=C2N=CN=C3NC(=O)NC4=NN=CS4)O)O

InChI

InChI=1S/C15H17N9O5S/c1-2-16-12(27)9-7(25)8(26)13(29-9)24-4-19-6-10(17-3-18-11(6)24)21-14(28)22-15-23-20-5-30-15/h3-5,7-9,13,25-26H,2H2,1H3,(H,16,27)(H2,17,18,21,22,23,28)