tert-butyl 4-(9-cyclopropyl-2-ethyl-6H-purin-1-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(9-cyclopropyl-2-ethyl-6H-purin-1-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(9-cyclopropyl-2-ethyl-6H-purin-1-yl)piperazine-1-carboxylate CAS Name: 4-(9-cyclopropyl-2-ethyl-6H-purin-1-yl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(9-cyclopropyl-2-ethyl-6H-purin-1-yl)piperazine-1-carboxylate Traditional Name: 4-(9-cyclopropyl-2-ethyl-6H-purin-1-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C19H30N6O2 MolecularWeight: 374.4805

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(CN1N3CCN(CC3)C(=O)OC(C)(C)C)N=CN2C4CC4

Isomeric SMILES

CCC1=NC2=C(CN1N3CCN(CC3)C(=O)OC(C)(C)C)N=CN2C4CC4

InChI

InChI=1S/C19H30N6O2/c1-5-16-21-17-15(20-13-24(17)14-6-7-14)12-25(16)23-10-8-22(9-11-23)18(26)27-19(2,3)4/h13-14H,5-12H2,1-4H3