1-[1,3-dimethyl-2,6-bis(oxidanylidene)-7-pentyl-purin-8-yl]piperidine-4-carboxamide

Systemtic Name: 1-[1,3-dimethyl-2,6-bis(oxidanylidene)-7-pentyl-purin-8-yl]piperidine-4-carboxamide Openeye Name: 1-(1,3-dimethyl-2,6-dioxo-7-pentyl-purin-8-yl)piperidine-4-carboxamide CAS Name: 1-(1,3-dimethyl-2,6-dioxo-7-pentyl-8-purinyl)-4-piperidinecarboxamide IUPAC Name: 1-(1,3-dimethyl-2,6-dioxo-7-pentylpurin-8-yl)piperidine-4-carboxamide Traditional Name: 1-(7-amyl-2,6-diketo-1,3-dimethyl-purin-8-yl)isonipecotamide Formula: C18H28N6O3 MolecularWeight: 376.45332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=C(N=C1N3CCC(CC3)C(=O)N)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CCCCCN1C2=C(N=C1N3CCC(CC3)C(=O)N)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C18H28N6O3/c1-4-5-6-9-24-13-15(21(2)18(27)22(3)16(13)26)20-17(24)23-10-7-12(8-11-23)14(19)25/h12H,4-11H2,1-3H3,(H2,19,25)