tert-butyl N-[[7-[(4-tert-butylphenyl)methyl]-6-oxidanylidene-3H-purin-2-yl]methyl]-N-methyl-carbamate

Systemtic Name: tert-butyl N-[[7-[(4-tert-butylphenyl)methyl]-6-oxidanylidene-3H-purin-2-yl]methyl]-N-methyl-carbamate Openeye Name: tert-butyl N-[[7-[(4-tert-butylphenyl)methyl]-6-oxo-3H-purin-2-yl]methyl]-N-methyl-carbamate CAS Name: N-[[7-[(4-tert-butylphenyl)methyl]-6-oxo-3H-purin-2-yl]methyl]-N-methylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[7-[(4-tert-butylphenyl)methyl]-6-oxo-3H-purin-2-yl]methyl]-N-methylcarbamate Traditional Name: N-[[7-(4-tert-butylbenzyl)-6-keto-3H-purin-2-yl]methyl]-N-methyl-carbamic acid tert-butyl ester Formula: C23H31N5O3 MolecularWeight: 425.52394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2C=NC3=C2C(=O)N=C(N3)CN(C)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2C=NC3=C2C(=O)N=C(N3)CN(C)C(=O)OC(C)(C)C

InChI

InChI=1S/C23H31N5O3/c1-22(2,3)16-10-8-15(9-11-16)12-28-14-24-19-18(28)20(29)26-17(25-19)13-27(7)21(30)31-23(4,5)6/h8-11,14H,12-13H2,1-7H3,(H,25,26,29)