tert-butyl 4-(9-methyl-8-pyrrolidin-1-yl-6H-purin-1-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(9-methyl-8-pyrrolidin-1-yl-6H-purin-1-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(9-methyl-8-pyrrolidin-1-yl-6H-purin-1-yl)piperazine-1-carboxylate CAS Name: 4-[9-methyl-8-(1-pyrrolidinyl)-6H-purin-1-yl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(9-methyl-8-pyrrolidin-1-yl-6H-purin-1-yl)piperazine-1-carboxylate Traditional Name: 4-(9-methyl-8-pyrrolidino-6H-purin-1-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C19H31N7O2 MolecularWeight: 389.49514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)N2CC3=C(N=C2)N(C(=N3)N4CCCC4)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)N2CC3=C(N=C2)N(C(=N3)N4CCCC4)C

InChI

InChI=1S/C19H31N7O2/c1-19(2,3)28-18(27)24-9-11-25(12-10-24)26-13-15-16(20-14-26)22(4)17(21-15)23-7-5-6-8-23/h14H,5-13H2,1-4H3