tert-butyl 4-(2-azanyl-7H-purin-6-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(2-azanyl-7H-purin-6-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(2-amino-7H-purin-6-yl)piperazine-1-carboxylate CAS Name: 4-(2-amino-7H-purin-6-yl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-amino-7H-purin-6-yl)piperazine-1-carboxylate Traditional Name: 4-(2-amino-7H-purin-6-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C14H21N7O2 MolecularWeight: 319.36224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC(=NC3=C2NC=N3)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC(=NC3=C2NC=N3)N

InChI

InChI=1S/C14H21N7O2/c1-14(2,3)23-13(22)21-6-4-20(5-7-21)11-9-10(17-8-16-9)18-12(15)19-11/h8H,4-7H2,1-3H3,(H3,15,16,17,18,19)