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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N4OS/c1-13(2,3)6-17-10-8(11(19)16-12(17)18)14-9(15-10)7-4-5-7/h7H,4-6H2,1-3H3,(H,14,15)(H,16,18,19)