8-cyclopropyl-3-(2-methylbutyl)-6-sulfanylidene-7H-purin-2-one

Systemtic Name: 8-cyclopropyl-3-(2-methylbutyl)-6-sulfanylidene-7H-purin-2-one Openeye Name: 8-cyclopropyl-3-(2-methylbutyl)-6-thioxo-7H-purin-2-one CAS Name: 8-cyclopropyl-3-(2-methylbutyl)-6-sulfanylidene-7H-purin-2-one IUPAC Name: 8-cyclopropyl-3-(2-methylbutyl)-6-sulfanylidene-7H-purin-2-one Traditional Name: 8-cyclopropyl-3-(2-methylbutyl)-6-thioxo-7H-purin-2-one Formula: C13H18N4OS MolecularWeight: 278.37322

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CN1C2=C(C(=S)NC1=O)NC(=N2)C3CC3

Isomeric SMILES

CCC(C)CN1C2=C(C(=S)NC1=O)NC(=N2)C3CC3

InChI

InChI=1S/C13H18N4OS/c1-3-7(2)6-17-11-9(12(19)16-13(17)18)14-10(15-11)8-4-5-8/h7-8H,3-6H2,1-2H3,(H,14,15)(H,16,18,19)