4-[2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-8-yl]-2-oxidanyl-ethyl]-N,N-diethyl-piperazine-1-carboxamide

Systemtic Name: 4-[2-[3,7-dimethyl-2,6-bis(oxidanylidene)purin-8-yl]-2-oxidanyl-ethyl]-N,N-diethyl-piperazine-1-carboxamide Openeye Name: 4-[2-(3,7-dimethyl-2,6-dioxo-purin-8-yl)-2-hydroxy-ethyl]-N,N-diethyl-piperazine-1-carboxamide CAS Name: 4-[2-(3,7-dimethyl-2,6-dioxo-8-purinyl)-2-hydroxyethyl]-N,N-diethyl-1-piperazinecarboxamide IUPAC Name: 4-[2-(3,7-dimethyl-2,6-dioxopurin-8-yl)-2-hydroxyethyl]-N,N-diethylpiperazine-1-carboxamide Traditional Name: 4-[2-(2,6-diketo-3,7-dimethyl-purin-8-yl)-2-hydroxy-ethyl]-N,N-diethyl-piperazine-1-carboxamide Formula: C18H29N7O4 MolecularWeight: 407.46736

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)N1CCN(CC1)CC(C2=NC3=C(N2C)C(=O)NC(=O)N3C)O

Isomeric SMILES

CCN(CC)C(=O)N1CCN(CC1)CC(C2=NC3=C(N2C)C(=O)NC(=O)N3C)O

InChI

InChI=1S/C18H29N7O4/c1-5-24(6-2)18(29)25-9-7-23(8-10-25)11-12(26)14-19-15-13(21(14)3)16(27)20-17(28)22(15)4/h12,26H,5-11H2,1-4H3,(H,20,27,28)