N-[5-[2,6-bis(oxidanylidene)-1,3-dipropyl-7H-purin-8-yl]pentyl]-2-bromanyl-ethanamide

Systemtic Name: N-[5-[2,6-bis(oxidanylidene)-1,3-dipropyl-7H-purin-8-yl]pentyl]-2-bromanyl-ethanamide Openeye Name: 2-bromo-N-[5-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)pentyl]acetamide CAS Name: 2-bromo-N-[5-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)pentyl]acetamide IUPAC Name: 2-bromo-N-[5-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)pentyl]acetamide Traditional Name: 2-bromo-N-[5-(2,6-diketo-1,3-dipropyl-7H-purin-8-yl)pentyl]acetamide Formula: C18H28BrN5O3 MolecularWeight: 442.35062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)CCCCCNC(=O)CBr

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)CCCCCNC(=O)CBr

InChI

InChI=1S/C18H28BrN5O3/c1-3-10-23-16-15(17(26)24(11-4-2)18(23)27)21-13(22-16)8-6-5-7-9-20-14(25)12-19/h3-12H2,1-2H3,(H,20,25)(H,21,22)