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

Systemtic Name: [5-(4-azanyl-5-ethenyl-2-oxidanylidene-pyrimidin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl 2-phenylsulfanylethyl carbonate Openeye Name: [5-(4-amino-2-oxo-5-vinyl-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl 2-phenylsulfanylethyl carbonate CAS Name: carbonic acid [5-(4-amino-5-ethenyl-2-oxo-1-pyrimidinyl)-3,4-dihydroxy-2-oxolanyl]methyl 2-(phenylthio)ethyl ester IUPAC Name: [5-(4-amino-5-ethenyl-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl 2-phenylsulfanylethyl carbonate Traditional Name: carbonic acid [5-(4-amino-2-keto-5-vinyl-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl 2-(phenylthio)ethyl ester Formula: C20H23N3O7S MolecularWeight: 449.47752

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=CN(C(=O)N=C1N)C2C(C(C(O2)COC(=O)OCCSC3=CC=CC=C3)O)O

Isomeric SMILES

C=CC1=CN(C(=O)N=C1N)C2C(C(C(O2)COC(=O)OCCSC3=CC=CC=C3)O)O

InChI

InChI=1S/C20H23N3O7S/c1-2-12-10-23(19(26)22-17(12)21)18-16(25)15(24)14(30-18)11-29-20(27)28-8-9-31-13-6-4-3-5-7-13/h2-7,10,14-16,18,24-25H,1,8-9,11H2,(H2,21,22,26)