7-methyl-2-(3-methylbutylsulfanyl)-5H-purin-6-one

Systemtic Name: 7-methyl-2-(3-methylbutylsulfanyl)-5H-purin-6-one Openeye Name: 2-isopentylsulfanyl-7-methyl-5H-purin-6-one CAS Name: 7-methyl-2-(3-methylbutylthio)-5H-purin-6-one IUPAC Name: 7-methyl-2-(3-methylbutylsulfanyl)-5H-purin-6-one Traditional Name: 2-(isoamylthio)-7-methyl-5H-purin-6-one Formula: C11H16N4OS MolecularWeight: 252.33594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=NC(=O)C2C(=N1)N=CN2C

Isomeric SMILES

CC(C)CCSC1=NC(=O)C2C(=N1)N=CN2C

InChI

InChI=1S/C11H16N4OS/c1-7(2)4-5-17-11-13-9-8(10(16)14-11)15(3)6-12-9/h6-8H,4-5H2,1-3H3