8-tert-butyl-3-[2-(2-hydroxyethylsulfonyl)ethyl]-1-propyl-7H-purine-2,6-dione

Systemtic Name: 8-tert-butyl-3-[2-(2-hydroxyethylsulfonyl)ethyl]-1-propyl-7H-purine-2,6-dione Openeye Name: 8-tert-butyl-3-[2-(2-hydroxyethylsulfonyl)ethyl]-1-propyl-7H-purine-2,6-dione CAS Name: 8-tert-butyl-3-[2-(2-hydroxyethylsulfonyl)ethyl]-1-propyl-7H-purine-2,6-dione IUPAC Name: 8-tert-butyl-3-[2-(2-hydroxyethylsulfonyl)ethyl]-1-propyl-7H-purine-2,6-dione Traditional Name: 8-tert-butyl-3-[2-(2-hydroxyethylsulfonyl)ethyl]-1-propyl-7H-purine-2,6-quinone Formula: C16H26N4O5S MolecularWeight: 386.46644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(N=C(N2)C(C)(C)C)N(C1=O)CCS(=O)(=O)CCO

Isomeric SMILES

CCCN1C(=O)C2=C(N=C(N2)C(C)(C)C)N(C1=O)CCS(=O)(=O)CCO

InChI

InChI=1S/C16H26N4O5S/c1-5-6-20-13(22)11-12(18-14(17-11)16(2,3)4)19(15(20)23)7-9-26(24,25)10-8-21/h21H,5-10H2,1-4H3,(H,17,18)