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

Systemtic Name: 8-butyl-3-propyl-6-sulfanylidene-7H-purin-2-one Openeye Name: 8-butyl-3-propyl-6-thioxo-7H-purin-2-one CAS Name: 8-butyl-3-propyl-6-sulfanylidene-7H-purin-2-one IUPAC Name: 8-butyl-3-propyl-6-sulfanylidene-7H-purin-2-one Traditional Name: 8-butyl-3-propyl-6-thioxo-7H-purin-2-one Formula: C12H18N4OS MolecularWeight: 266.36252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1)C(=S)NC(=O)N2CCC

Isomeric SMILES

CCCCC1=NC2=C(N1)C(=S)NC(=O)N2CCC

InChI

InChI=1S/C12H18N4OS/c1-3-5-6-8-13-9-10(14-8)16(7-4-2)12(17)15-11(9)18/h3-7H2,1-2H3,(H,13,14)(H,15,17,18)