N-cyclohexyl-N-ethyl-2-[7-ethyl-2,6-bis(oxidanylidene)-3-(phenylmethyl)purin-1-yl]ethanamide

Systemtic Name: N-cyclohexyl-N-ethyl-2-[7-ethyl-2,6-bis(oxidanylidene)-3-(phenylmethyl)purin-1-yl]ethanamide Openeye Name: 2-(3-benzyl-7-ethyl-2,6-dioxo-purin-1-yl)-N-cyclohexyl-N-ethyl-acetamide CAS Name: N-cyclohexyl-N-ethyl-2-[7-ethyl-2,6-dioxo-3-(phenylmethyl)-1-purinyl]acetamide IUPAC Name: 2-(3-benzyl-7-ethyl-2,6-dioxopurin-1-yl)-N-cyclohexyl-N-ethylacetamide Traditional Name: 2-(3-benzyl-7-ethyl-2,6-diketo-purin-1-yl)-N-cyclohexyl-N-ethyl-acetamide Formula: C24H31N5O3 MolecularWeight: 437.53464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1C(=O)N(C(=O)N2CC3=CC=CC=C3)CC(=O)N(CC)C4CCCCC4

Isomeric SMILES

CCN1C=NC2=C1C(=O)N(C(=O)N2CC3=CC=CC=C3)CC(=O)N(CC)C4CCCCC4

InChI

InChI=1S/C24H31N5O3/c1-3-26-17-25-22-21(26)23(31)29(24(32)28(22)15-18-11-7-5-8-12-18)16-20(30)27(4-2)19-13-9-6-10-14-19/h5,7-8,11-12,17,19H,3-4,6,9-10,13-16H2,1-2H3