tert-butyl 4-(2-methoxy-9-propan-2-yl-6H-purin-1-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(2-methoxy-9-propan-2-yl-6H-purin-1-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(9-isopropyl-2-methoxy-6H-purin-1-yl)piperazine-1-carboxylate CAS Name: 4-(2-methoxy-9-propan-2-yl-6H-purin-1-yl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-methoxy-9-propan-2-yl-6H-purin-1-yl)piperazine-1-carboxylate Traditional Name: 4-(9-isopropyl-2-methoxy-6H-purin-1-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C18H30N6O3 MolecularWeight: 378.4692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N(C2)N3CCN(CC3)C(=O)OC(C)(C)C)OC

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N(C2)N3CCN(CC3)C(=O)OC(C)(C)C)OC

InChI

InChI=1S/C18H30N6O3/c1-13(2)23-12-19-14-11-24(16(26-6)20-15(14)23)22-9-7-21(8-10-22)17(25)27-18(3,4)5/h12-13H,7-11H2,1-6H3