[5-(4-azanyl-5-iodanyl-2-oxidanylidene-pyrimidin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl 2-phenylsulfanylethyl carbonate

Systemtic Name: [5-(4-azanyl-5-iodanyl-2-oxidanylidene-pyrimidin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl 2-phenylsulfanylethyl carbonate Openeye Name: [5-(4-amino-5-iodo-2-oxo-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl 2-phenylsulfanylethyl carbonate CAS Name: carbonic acid [5-(4-amino-5-iodo-2-oxo-1-pyrimidinyl)-3,4-dihydroxy-2-oxolanyl]methyl 2-(phenylthio)ethyl ester IUPAC Name: [5-(4-amino-5-iodo-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl 2-phenylsulfanylethyl carbonate Traditional Name: carbonic acid [5-(4-amino-5-iodo-2-keto-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl 2-(phenylthio)ethyl ester Formula: C18H20IN3O7S MolecularWeight: 549.33677

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCOC(=O)OCC2C(C(C(O2)N3C=C(C(=NC3=O)N)I)O)O

Isomeric SMILES

C1=CC=C(C=C1)SCCOC(=O)OCC2C(C(C(O2)N3C=C(C(=NC3=O)N)I)O)O

InChI

InChI=1S/C18H20IN3O7S/c19-11-8-22(17(25)21-15(11)20)16-14(24)13(23)12(29-16)9-28-18(26)27-6-7-30-10-4-2-1-3-5-10/h1-5,8,12-14,16,23-24H,6-7,9H2,(H2,20,21,25)