tert-butyl 4-(2,9-dimethyl-6H-purin-1-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(2,9-dimethyl-6H-purin-1-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(2,9-dimethyl-6H-purin-1-yl)piperazine-1-carboxylate CAS Name: 4-(2,9-dimethyl-6H-purin-1-yl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2,9-dimethyl-6H-purin-1-yl)piperazine-1-carboxylate Traditional Name: 4-(2,9-dimethyl-6H-purin-1-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C16H26N6O2 MolecularWeight: 334.41664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(CN1N3CCN(CC3)C(=O)OC(C)(C)C)N=CN2C

Isomeric SMILES

CC1=NC2=C(CN1N3CCN(CC3)C(=O)OC(C)(C)C)N=CN2C

InChI

InChI=1S/C16H26N6O2/c1-12-18-14-13(17-11-19(14)5)10-22(12)21-8-6-20(7-9-21)15(23)24-16(2,3)4/h11H,6-10H2,1-5H3