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(phenylmethyl) 6-azanyl-1-[2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylamino]ethanoyl]purine-2-carboxylate

(phenylmethyl) 6-azanyl-1-[2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylamino]ethanoyl]purine-2-carboxylate

Systemtic Name:(phenylmethyl) 6-azanyl-1-[2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylamino]ethanoyl]purine-2-carboxylate
Openeye Name:benzyl 6-amino-1-[2-[2-(tert-butoxycarbonylamino)ethylamino]acetyl]purine-2-carboxylate
CAS Name:6-amino-1-[2-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]ethylamino]-1-oxoethyl]-2-purinecarboxylic acid (phenylmethyl) ester
IUPAC Name:benzyl 6-amino-1-[2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylamino]acetyl]purine-2-carboxylate
Traditional Name:6-amino-1-[2-[2-(tert-butoxycarbonylamino)ethylamino]acetyl]purine-2-carboxylic acid benzyl ester
Formula: C22H27N7O5
MolecularWeight: 469.49368
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCNCC(=O)N1C(=C2C(=NC=N2)N=C1C(=O)OCC3=CC=CC=C3)N


Isomeric SMILES

CC(C)(C)OC(=O)NCCNCC(=O)N1C(=C2C(=NC=N2)N=C1C(=O)OCC3=CC=CC=C3)N


InChI

InChI=1S/C22H27N7O5/c1-22(2,3)34-21(32)25-10-9-24-11-15(30)29-17(23)16-18(27-13-26-16)28-19(29)20(31)33-12-14-7-5-4-6-8-14/h4-8,13,24H,9-12,23H2,1-3H3,(H,25,32)


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