2-[1,3-dimethyl-2,6-bis(oxidanylidene)-7-propyl-purin-8-yl]sulfanyl-N-(1,3-thiazol-2-yl)ethanamide

Systemtic Name: 2-[1,3-dimethyl-2,6-bis(oxidanylidene)-7-propyl-purin-8-yl]sulfanyl-N-(1,3-thiazol-2-yl)ethanamide Openeye Name: 2-(1,3-dimethyl-2,6-dioxo-7-propyl-purin-8-yl)sulfanyl-N-thiazol-2-yl-acetamide CAS Name: 2-[(1,3-dimethyl-2,6-dioxo-7-propyl-8-purinyl)thio]-N-(2-thiazolyl)acetamide IUPAC Name: 2-(1,3-dimethyl-2,6-dioxo-7-propylpurin-8-yl)sulfanyl-N-(1,3-thiazol-2-yl)acetamide Traditional Name: 2-[(2,6-diketo-1,3-dimethyl-7-propyl-purin-8-yl)thio]-N-thiazol-2-yl-acetamide Formula: C15H18N6O3S2 MolecularWeight: 394.47182

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(N=C1SCC(=O)NC3=NC=CS3)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CCCN1C2=C(N=C1SCC(=O)NC3=NC=CS3)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C15H18N6O3S2/c1-4-6-21-10-11(19(2)15(24)20(3)12(10)23)18-14(21)26-8-9(22)17-13-16-5-7-25-13/h5,7H,4,6,8H2,1-3H3,(H,16,17,22)