hexadecoxy-[[(2S,5R)-5-(6-oxidanylidene-3H-purin-9-yl)oxolan-2-yl]methoxy]-sulfanylidene-phosphanium

Systemtic Name: hexadecoxy-[[(2S,5R)-5-(6-oxidanylidene-3H-purin-9-yl)oxolan-2-yl]methoxy]-sulfanylidene-phosphanium Openeye Name: hexadecoxy-[[(2S,5R)-5-(6-oxo-3H-purin-9-yl)tetrahydrofuran-2-yl]methoxy]-thioxo-phosphonium CAS Name: hexadecoxy-[[(2S,5R)-5-(6-oxo-3H-purin-9-yl)-2-oxolanyl]methoxy]-sulfanylidenephosphonium IUPAC Name: hexadecoxy-[[(2S,5R)-5-(6-oxo-3H-purin-9-yl)oxolan-2-yl]methoxy]-sulfanylidenephosphanium Traditional Name: cetyloxy-[[(2S,5R)-5-(6-keto-3H-purin-9-yl)tetrahydrofuran-2-yl]methoxy]-thioxo-phosphonium Formula: C26H44N4O4PS+ MolecularWeight: 539.690721

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCO[P+](=S)OCC1CCC(O1)N2C=NC3=C2NC=NC3=O

Isomeric SMILES

CCCCCCCCCCCCCCCCO[P+](=S)OC[C@@H]1CC[C@@H](O1)N2C=NC3=C2NC=NC3=O

InChI

InChI=1S/C26H43N4O4PS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-32-35(36)33-19-22-16-17-23(34-22)30-21-29-24-25(30)27-20-28-26(24)31/h20-23H,2-19H2,1H3/p+1/t22-,23+/m0/s1