[3-[2-[5-[(3aS,6aR)-2-oxidanylidene-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]ethoxy-oxidanyl-phosphoryl]oxy-2-acetyloxy-propyl] ethanoate

Systemtic Name: [3-[2-[5-[(3aS,6aR)-2-oxidanylidene-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]ethoxy-oxidanyl-phosphoryl]oxy-2-acetyloxy-propyl] ethanoate Openeye Name: [3-[2-[5-[(3aS,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]ethoxy-hydroxy-phosphoryl]oxy-2-acetoxy-propyl] acetate CAS Name: acetic acid [3-[2-[[5-[(3aS,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-1-oxopentyl]amino]ethoxy-hydroxyphosphoryl]oxy-2-acetyloxypropyl] ester IUPAC Name: [3-[2-[5-[(3aS,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]ethoxy-hydroxyphosphoryl]oxy-2-acetyloxypropyl] acetate Traditional Name: acetic acid [3-[2-[5-[(3aS,6aR)-2-keto-1,3,3a,4,6,6a-hexahydrothien[3,4-d]imidazol-4-yl]pentanoylamino]ethoxy-hydroxy-phosphoryl]oxy-2-acetoxy-propyl] ester Formula: C19H32N3O10PS MolecularWeight: 525.510241

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(COP(=O)(O)OCCNC(=O)CCCCC1C2C(CS1)NC(=O)N2)OC(=O)C

Isomeric SMILES

CC(=O)OCC(COP(=O)(O)OCCNC(=O)CCCCC1[C@@H]2[C@H](CS1)NC(=O)N2)OC(=O)C

InChI

InChI=1S/C19H32N3O10PS/c1-12(23)29-9-14(32-13(2)24)10-31-33(27,28)30-8-7-20-17(25)6-4-3-5-16-18-15(11-34-16)21-19(26)22-18/h14-16,18H,3-11H2,1-2H3,(H,20,25)(H,27,28)(H2,21,22,26)/t14?,15-,16?,18-/m0/s1