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

Systemtic Name: 1-[1,3-dimethyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]-4-piperidin-1-yl-piperidine-4-carboxamide Openeye Name: 1-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)-4-(1-piperidyl)piperidine-4-carboxamide CAS Name: 1-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)-4-(1-piperidinyl)-4-piperidinecarboxamide IUPAC Name: 1-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)-4-piperidin-1-ylpiperidine-4-carboxamide Traditional Name: 1-(2,6-diketo-1,3-dimethyl-7H-purin-8-yl)-4-piperidino-isonipecotamide Formula: C18H27N7O3 MolecularWeight: 389.45208

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)N3CCC(CC3)(C(=O)N)N4CCCCC4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)N3CCC(CC3)(C(=O)N)N4CCCCC4

InChI

InChI=1S/C18H27N7O3/c1-22-13-12(14(26)23(2)17(22)28)20-16(21-13)24-10-6-18(7-11-24,15(19)27)25-8-4-3-5-9-25/h3-11H2,1-2H3,(H2,19,27)(H,20,21)