2-[7-hexyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-8-yl]sulfanylethanamide

Systemtic Name: 2-[7-hexyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-8-yl]sulfanylethanamide Openeye Name: 2-(7-hexyl-1,3-dimethyl-2,6-dioxo-purin-8-yl)sulfanylacetamide CAS Name: 2-[(7-hexyl-1,3-dimethyl-2,6-dioxo-8-purinyl)thio]acetamide IUPAC Name: 2-(7-hexyl-1,3-dimethyl-2,6-dioxopurin-8-yl)sulfanylacetamide Traditional Name: 2-[(7-hexyl-2,6-diketo-1,3-dimethyl-purin-8-yl)thio]acetamide Formula: C15H23N5O3S MolecularWeight: 353.43982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=C(N=C1SCC(=O)N)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CCCCCCN1C2=C(N=C1SCC(=O)N)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C15H23N5O3S/c1-4-5-6-7-8-20-11-12(17-14(20)24-9-10(16)21)18(2)15(23)19(3)13(11)22/h4-9H2,1-3H3,(H2,16,21)