tert-butyl 2-[2-(2-methylpropanoylamino)-6-oxidanylidene-3H-purin-9-yl]-2,3-dihydrofuran-5-carboxylate

Systemtic Name: tert-butyl 2-[2-(2-methylpropanoylamino)-6-oxidanylidene-3H-purin-9-yl]-2,3-dihydrofuran-5-carboxylate Openeye Name: tert-butyl 2-[2-(2-methylpropanoylamino)-6-oxo-3H-purin-9-yl]-2,3-dihydrofuran-5-carboxylate CAS Name: 2-[2-[(2-methyl-1-oxopropyl)amino]-6-oxo-3H-purin-9-yl]-2,3-dihydrofuran-5-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[2-(2-methylpropanoylamino)-6-oxo-3H-purin-9-yl]-2,3-dihydrofuran-5-carboxylate Traditional Name: 2-[2-(isobutyrylamino)-6-keto-3H-purin-9-yl]-2,3-dihydrofuran-5-carboxylic acid tert-butyl ester Formula: C18H23N5O5 MolecularWeight: 389.40572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=NC(=O)C2=C(N1)N(C=N2)C3CC=C(O3)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)C(=O)NC1=NC(=O)C2=C(N1)N(C=N2)C3CC=C(O3)C(=O)OC(C)(C)C

InChI

InChI=1S/C18H23N5O5/c1-9(2)14(24)21-17-20-13-12(15(25)22-17)19-8-23(13)11-7-6-10(27-11)16(26)28-18(3,4)5/h6,8-9,11H,7H2,1-5H3,(H2,20,21,22,24,25)