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

Systemtic Name: 1-[3-methyl-7-(2-methylprop-2-enyl)-2,6-bis(oxidanylidene)purin-8-yl]piperidine-4-carboxamide Openeye Name: 1-[3-methyl-7-(2-methylallyl)-2,6-dioxo-purin-8-yl]piperidine-4-carboxamide CAS Name: 1-[3-methyl-7-(2-methylprop-2-enyl)-2,6-dioxo-8-purinyl]-4-piperidinecarboxamide IUPAC Name: 1-[3-methyl-7-(2-methylprop-2-enyl)-2,6-dioxopurin-8-yl]piperidine-4-carboxamide Traditional Name: 1-[2,6-diketo-3-methyl-7-(2-methylallyl)purin-8-yl]isonipecotamide Formula: C16H22N6O3 MolecularWeight: 346.38428

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CN1C2=C(N=C1N3CCC(CC3)C(=O)N)N(C(=O)NC2=O)C

Isomeric SMILES

CC(=C)CN1C2=C(N=C1N3CCC(CC3)C(=O)N)N(C(=O)NC2=O)C

InChI

InChI=1S/C16H22N6O3/c1-9(2)8-22-11-13(20(3)16(25)19-14(11)24)18-15(22)21-6-4-10(5-7-21)12(17)23/h10H,1,4-8H2,2-3H3,(H2,17,23)(H,19,24,25)