tert-butyl 4-[1,3-dimethyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[1,3-dimethyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)piperazine-1-carboxylate CAS Name: 4-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)piperazine-1-carboxylate Traditional Name: 4-(2,6-diketo-1,3-dimethyl-7H-purin-8-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C16H24N6O4 MolecularWeight: 364.39956

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC3=C(N2)C(=O)N(C(=O)N3C)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC3=C(N2)C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C16H24N6O4/c1-16(2,3)26-15(25)22-8-6-21(7-9-22)13-17-10-11(18-13)19(4)14(24)20(5)12(10)23/h6-9H2,1-5H3,(H,17,18)