1,3-dimethyl-8-(2-oxidanylidenepropylsulfanyl)-6-sulfanylidene-7H-purin-2-one

Systemtic Name: 1,3-dimethyl-8-(2-oxidanylidenepropylsulfanyl)-6-sulfanylidene-7H-purin-2-one Openeye Name: 8-acetonylsulfanyl-1,3-dimethyl-6-thioxo-7H-purin-2-one CAS Name: 1,3-dimethyl-8-(2-oxopropylthio)-6-sulfanylidene-7H-purin-2-one IUPAC Name: 1,3-dimethyl-8-(2-oxopropylsulfanyl)-6-sulfanylidene-7H-purin-2-one Traditional Name: 8-(acetonylthio)-1,3-dimethyl-6-thioxo-7H-purin-2-one Formula: C10H12N4O2S2 MolecularWeight: 284.35788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=NC2=C(N1)C(=S)N(C(=O)N2C)C

Isomeric SMILES

CC(=O)CSC1=NC2=C(N1)C(=S)N(C(=O)N2C)C

InChI

InChI=1S/C10H12N4O2S2/c1-5(15)4-18-9-11-6-7(12-9)13(2)10(16)14(3)8(6)17/h4H2,1-3H3,(H,11,12)