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

Systemtic Name: 1-[3-methyl-2,6-bis(oxidanylidene)-7-pentyl-purin-8-yl]piperidine-4-carboxamide Openeye Name: 1-(3-methyl-2,6-dioxo-7-pentyl-purin-8-yl)piperidine-4-carboxamide CAS Name: 1-(3-methyl-2,6-dioxo-7-pentyl-8-purinyl)-4-piperidinecarboxamide IUPAC Name: 1-(3-methyl-2,6-dioxo-7-pentylpurin-8-yl)piperidine-4-carboxamide Traditional Name: 1-(7-amyl-2,6-diketo-3-methyl-purin-8-yl)isonipecotamide Formula: C17H26N6O3 MolecularWeight: 362.42674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=C(N=C1N3CCC(CC3)C(=O)N)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCCN1C2=C(N=C1N3CCC(CC3)C(=O)N)N(C(=O)NC2=O)C

InChI

InChI=1S/C17H26N6O3/c1-3-4-5-8-23-12-14(21(2)17(26)20-15(12)25)19-16(23)22-9-6-11(7-10-22)13(18)24/h11H,3-10H2,1-2H3,(H2,18,24)(H,20,25,26)