2-[8-chloranyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[8-chloranyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-(8-chloro-1,3-dimethyl-2,6-dioxo-purin-7-yl)-N-(2-thienylmethyl)acetamide CAS Name: 2-(8-chloro-1,3-dimethyl-2,6-dioxo-7-purinyl)-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-(8-chloro-1,3-dimethyl-2,6-dioxopurin-7-yl)-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-(8-chloro-2,6-diketo-1,3-dimethyl-purin-7-yl)-N-(2-thenyl)acetamide Formula: C14H14ClN5O3S MolecularWeight: 367.81066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Cl)CC(=O)NCC3=CC=CS3

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Cl)CC(=O)NCC3=CC=CS3

InChI

InChI=1S/C14H14ClN5O3S/c1-18-11-10(12(22)19(2)14(18)23)20(13(15)17-11)7-9(21)16-6-8-4-3-5-24-8/h3-5H,6-7H2,1-2H3,(H,16,21)