tert-butyl N-[4-[[6-(piperidin-1-ylamino)-9-propan-2-yl-purin-2-yl]amino]cyclohexyl]carbamate

Systemtic Name: tert-butyl N-[4-[[6-(piperidin-1-ylamino)-9-propan-2-yl-purin-2-yl]amino]cyclohexyl]carbamate Openeye Name: tert-butyl N-[4-[[9-isopropyl-6-(1-piperidylamino)purin-2-yl]amino]cyclohexyl]carbamate CAS Name: N-[4-[[6-(1-piperidinylamino)-9-propan-2-yl-2-purinyl]amino]cyclohexyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[[6-(piperidin-1-ylamino)-9-propan-2-ylpurin-2-yl]amino]cyclohexyl]carbamate Traditional Name: N-[4-[[9-isopropyl-6-(piperidinoamino)purin-2-yl]amino]cyclohexyl]carbamic acid tert-butyl ester Formula: C24H40N8O2 MolecularWeight: 472.6268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NN3CCCCC3)NC4CCC(CC4)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NN3CCCCC3)NC4CCC(CC4)NC(=O)OC(C)(C)C

InChI

InChI=1S/C24H40N8O2/c1-16(2)32-15-25-19-20(30-31-13-7-6-8-14-31)28-22(29-21(19)32)26-17-9-11-18(12-10-17)27-23(33)34-24(3,4)5/h15-18H,6-14H2,1-5H3,(H,27,33)(H2,26,28,29,30)