2-[3-butyl-7-(furan-2-ylmethyl)-2,6-bis(oxidanylidene)purin-1-yl]ethanamide

Systemtic Name: 2-[3-butyl-7-(furan-2-ylmethyl)-2,6-bis(oxidanylidene)purin-1-yl]ethanamide Openeye Name: 2-[3-butyl-7-(2-furylmethyl)-2,6-dioxo-purin-1-yl]acetamide CAS Name: 2-[3-butyl-7-(2-furanylmethyl)-2,6-dioxo-1-purinyl]acetamide IUPAC Name: 2-[3-butyl-7-(furan-2-ylmethyl)-2,6-dioxopurin-1-yl]acetamide Traditional Name: 2-[3-butyl-7-(2-furfuryl)-2,6-diketo-purin-1-yl]acetamide Formula: C16H19N5O4 MolecularWeight: 345.35316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=O)N(C1=O)CC(=O)N)N(C=N2)CC3=CC=CO3

Isomeric SMILES

CCCCN1C2=C(C(=O)N(C1=O)CC(=O)N)N(C=N2)CC3=CC=CO3

InChI

InChI=1S/C16H19N5O4/c1-2-3-6-20-14-13(15(23)21(16(20)24)9-12(17)22)19(10-18-14)8-11-5-4-7-25-11/h4-5,7,10H,2-3,6,8-9H2,1H3,(H2,17,22)