1,3-dimethyl-8-(2-morpholin-4-ylethylsulfanyl)-2-sulfanylidene-7H-purin-6-one

Systemtic Name: 1,3-dimethyl-8-(2-morpholin-4-ylethylsulfanyl)-2-sulfanylidene-7H-purin-6-one Openeye Name: 1,3-dimethyl-8-(2-morpholinoethylsulfanyl)-2-thioxo-7H-purin-6-one CAS Name: 1,3-dimethyl-8-[2-(4-morpholinyl)ethylthio]-2-sulfanylidene-7H-purin-6-one IUPAC Name: 1,3-dimethyl-8-(2-morpholin-4-ylethylsulfanyl)-2-sulfanylidene-7H-purin-6-one Traditional Name: 1,3-dimethyl-8-(2-morpholinoethylthio)-2-thioxo-7H-purin-6-one Formula: C13H19N5O2S2 MolecularWeight: 341.45226

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=S)C)NC(=N2)SCCN3CCOCC3

Isomeric SMILES

CN1C2=C(C(=O)N(C1=S)C)NC(=N2)SCCN3CCOCC3

InChI

InChI=1S/C13H19N5O2S2/c1-16-10-9(11(19)17(2)13(16)21)14-12(15-10)22-8-5-18-3-6-20-7-4-18/h3-8H2,1-2H3,(H,14,15)