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

Systemtic Name: 2-[1,3-dimethyl-7-(3-methylbutyl)-2,6-bis(oxidanylidene)purin-8-yl]sulfanylethanamide Openeye Name: 2-(7-isopentyl-1,3-dimethyl-2,6-dioxo-purin-8-yl)sulfanylacetamide CAS Name: 2-[[1,3-dimethyl-7-(3-methylbutyl)-2,6-dioxo-8-purinyl]thio]acetamide IUPAC Name: 2-[1,3-dimethyl-7-(3-methylbutyl)-2,6-dioxopurin-8-yl]sulfanylacetamide Traditional Name: 2-[(7-isoamyl-2,6-diketo-1,3-dimethyl-purin-8-yl)thio]acetamide Formula: C14H21N5O3S MolecularWeight: 339.41324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=C(N=C1SCC(=O)N)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CC(C)CCN1C2=C(N=C1SCC(=O)N)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C14H21N5O3S/c1-8(2)5-6-19-10-11(16-13(19)23-7-9(15)20)17(3)14(22)18(4)12(10)21/h8H,5-7H2,1-4H3,(H2,15,20)