N-[2-(7H-purin-6-ylsulfanyl)ethyl]ethanamide

Systemtic Name: N-[2-(7H-purin-6-ylsulfanyl)ethyl]ethanamide Openeye Name: N-[2-(7H-purin-6-ylsulfanyl)ethyl]acetamide CAS Name: N-[2-(7H-purin-6-ylthio)ethyl]acetamide IUPAC Name: N-[2-(7H-purin-6-ylsulfanyl)ethyl]acetamide Traditional Name: N-[2-(7H-purin-6-ylthio)ethyl]acetamide Formula: C9H11N5OS MolecularWeight: 237.28154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCSC1=NC=NC2=C1NC=N2

Isomeric SMILES

CC(=O)NCCSC1=NC=NC2=C1NC=N2

InChI

InChI=1S/C9H11N5OS/c1-6(15)10-2-3-16-9-7-8(12-4-11-7)13-5-14-9/h4-5H,2-3H2,1H3,(H,10,15)(H,11,12,13,14)