[5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-(2-ethanoylsulfanylethoxy)-oxidanylidene-phosphanium

Systemtic Name: [5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-(2-ethanoylsulfanylethoxy)-oxidanylidene-phosphanium Openeye Name: 2-acetylsulfanylethoxy-[[5-(6-aminopurin-9-yl)tetrahydrofuran-2-yl]methoxy]-oxo-phosphonium CAS Name: 2-(acetylthio)ethoxy-[[5-(6-aminopurin-9-yl)-2-oxolanyl]methoxy]-oxophosphonium IUPAC Name: 2-acetylsulfanylethoxy-[[5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy]-oxophosphanium Traditional Name: 2-(acetylthio)ethoxy-[(5-adenin-9-yltetrahydrofuran-2-yl)methoxy]-keto-phosphonium Formula: C14H19N5O5PS+ MolecularWeight: 400.369921

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCO[P+](=O)OCC1CCC(O1)N2C=NC3=C2N=CN=C3N

Isomeric SMILES

CC(=O)SCCO[P+](=O)OCC1CCC(O1)N2C=NC3=C2N=CN=C3N

InChI

InChI=1S/C14H19N5O5PS/c1-9(20)26-5-4-22-25(21)23-6-10-2-3-11(24-10)19-8-18-12-13(15)16-7-17-14(12)19/h7-8,10-11H,2-6H2,1H3,(H2,15,16,17)/q+1