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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCC(CC3)C(=O)N)CC=C

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCC(CC3)C(=O)N)CC=C

InChI

InChI=1S/C16H22N6O3/c1-4-7-22-11-13(19(2)16(25)20(3)14(11)24)18-15(22)21-8-5-10(6-9-21)12(17)23/h4,10H,1,5-9H2,2-3H3,(H2,17,23)