1,3-dimethyl-7-(2-methylpropyl)-6-sulfanylidene-purin-2-one

Systemtic Name: 1,3-dimethyl-7-(2-methylpropyl)-6-sulfanylidene-purin-2-one Openeye Name: 7-isobutyl-1,3-dimethyl-6-thioxo-purin-2-one CAS Name: 1,3-dimethyl-7-(2-methylpropyl)-6-sulfanylidene-2-purinone IUPAC Name: 1,3-dimethyl-7-(2-methylpropyl)-6-sulfanylidenepurin-2-one Traditional Name: 7-isobutyl-1,3-dimethyl-6-thioxo-purin-2-one Formula: C11H16N4OS MolecularWeight: 252.33594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=NC2=C1C(=S)N(C(=O)N2C)C

Isomeric SMILES

CC(C)CN1C=NC2=C1C(=S)N(C(=O)N2C)C

InChI

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