acetyloxymethyl 2-[3-[[6-azanyl-2-(2-methoxyethylsulfanyl)-8-oxidanylidene-7H-purin-9-yl]methyl]phenyl]ethanoate

Systemtic Name: acetyloxymethyl 2-[3-[[6-azanyl-2-(2-methoxyethylsulfanyl)-8-oxidanylidene-7H-purin-9-yl]methyl]phenyl]ethanoate Openeye Name: acetoxymethyl 2-[3-[[6-amino-2-(2-methoxyethylsulfanyl)-8-oxo-7H-purin-9-yl]methyl]phenyl]acetate CAS Name: 2-[3-[[6-amino-2-(2-methoxyethylthio)-8-oxo-7H-purin-9-yl]methyl]phenyl]acetic acid acetyloxymethyl ester IUPAC Name: acetyloxymethyl 2-[3-[[6-amino-2-(2-methoxyethylsulfanyl)-8-oxo-7H-purin-9-yl]methyl]phenyl]acetate Traditional Name: 2-[3-[[6-amino-8-keto-2-(2-methoxyethylthio)-7H-purin-9-yl]methyl]phenyl]acetic acid acetoxymethyl ester Formula: C20H23N5O6S MolecularWeight: 461.49152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCOC(=O)CC1=CC(=CC=C1)CN2C3=C(C(=NC(=N3)SCCOC)N)NC2=O

Isomeric SMILES

CC(=O)OCOC(=O)CC1=CC(=CC=C1)CN2C3=C(C(=NC(=N3)SCCOC)N)NC2=O

InChI

InChI=1S/C20H23N5O6S/c1-12(26)30-11-31-15(27)9-13-4-3-5-14(8-13)10-25-18-16(22-20(25)28)17(21)23-19(24-18)32-7-6-29-2/h3-5,8H,6-7,9-11H2,1-2H3,(H,22,28)(H2,21,23,24)