3-butyl-8-ethyl-6-sulfanylidene-7H-purin-2-one

Systemtic Name: 3-butyl-8-ethyl-6-sulfanylidene-7H-purin-2-one Openeye Name: 3-butyl-8-ethyl-6-thioxo-7H-purin-2-one CAS Name: 3-butyl-8-ethyl-6-sulfanylidene-7H-purin-2-one IUPAC Name: 3-butyl-8-ethyl-6-sulfanylidene-7H-purin-2-one Traditional Name: 3-butyl-8-ethyl-6-thioxo-7H-purin-2-one Formula: C11H16N4OS MolecularWeight: 252.33594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=S)NC1=O)NC(=N2)CC

Isomeric SMILES

CCCCN1C2=C(C(=S)NC1=O)NC(=N2)CC

InChI

InChI=1S/C11H16N4OS/c1-3-5-6-15-9-8(10(17)14-11(15)16)12-7(4-2)13-9/h3-6H2,1-2H3,(H,12,13)(H,14,16,17)