tert-butyl N-[(2-methylpropan-2-yl)oxycarbonyl]-N-[9-(phenylmethyl)purin-6-yl]carbamate

Systemtic Name: tert-butyl N-[(2-methylpropan-2-yl)oxycarbonyl]-N-[9-(phenylmethyl)purin-6-yl]carbamate Openeye Name: tert-butyl N-(9-benzylpurin-6-yl)-N-tert-butoxycarbonyl-carbamate CAS Name: N-[(2-methylpropan-2-yl)oxy-oxomethyl]-N-[9-(phenylmethyl)-6-purinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(9-benzylpurin-6-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate Traditional Name: N-(9-benzylpurin-6-yl)-N-tert-butoxycarbonyl-carbamic acid tert-butyl ester Formula: C22H27N5O4 MolecularWeight: 425.48088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C1=NC=NC2=C1N=CN2CC3=CC=CC=C3)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N(C1=NC=NC2=C1N=CN2CC3=CC=CC=C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H27N5O4/c1-21(2,3)30-19(28)27(20(29)31-22(4,5)6)18-16-17(23-13-24-18)26(14-25-16)12-15-10-8-7-9-11-15/h7-11,13-14H,12H2,1-6H3