tert-butyl N-[9-(4-methylphenyl)purin-6-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate

Systemtic Name: tert-butyl N-[9-(4-methylphenyl)purin-6-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate Openeye Name: tert-butyl N-tert-butoxycarbonyl-N-[9-(p-tolyl)purin-6-yl]carbamate CAS Name: N-[9-(4-methylphenyl)-6-purinyl]-N-[(2-methylpropan-2-yl)oxy-oxomethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[9-(4-methylphenyl)purin-6-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate Traditional Name: N-tert-butoxycarbonyl-N-[9-(p-tolyl)purin-6-yl]carbamic acid tert-butyl ester Formula: C22H27N5O4 MolecularWeight: 425.48088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=NC3=C2N=CN=C3N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C=NC3=C2N=CN=C3N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H27N5O4/c1-14-8-10-15(11-9-14)26-13-25-16-17(26)23-12-24-18(16)27(19(28)30-21(2,3)4)20(29)31-22(5,6)7/h8-13H,1-7H3