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

Systemtic Name: 2-[8-(azepan-1-yl)-1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanamide Openeye Name: 2-[8-(azepan-1-yl)-1,3-dimethyl-2,6-dioxo-purin-7-yl]acetamide CAS Name: 2-[8-(1-azepanyl)-1,3-dimethyl-2,6-dioxo-7-purinyl]acetamide IUPAC Name: 2-[8-(azepan-1-yl)-1,3-dimethyl-2,6-dioxopurin-7-yl]acetamide Traditional Name: 2-[8-(azepan-1-yl)-2,6-diketo-1,3-dimethyl-purin-7-yl]acetamide Formula: C15H22N6O3 MolecularWeight: 334.37358

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCCCCC3)CC(=O)N

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCCCCC3)CC(=O)N

InChI

InChI=1S/C15H22N6O3/c1-18-12-11(13(23)19(2)15(18)24)21(9-10(16)22)14(17-12)20-7-5-3-4-6-8-20/h3-9H2,1-2H3,(H2,16,22)