[(2R,3R,4R,5R)-3,4-diacetyloxy-5-[6-(2,2-diphenylethylamino)-2-[(2E)-2-(phenylcarbamoylimino)hydrazinyl]purin-9-yl]oxolan-2-yl]methyl ethanoate

Systemtic Name: [(2R,3R,4R,5R)-3,4-diacetyloxy-5-[6-(2,2-diphenylethylamino)-2-[(2E)-2-(phenylcarbamoylimino)hydrazinyl]purin-9-yl]oxolan-2-yl]methyl ethanoate Openeye Name: [(2R,3R,4R,5R)-3,4-diacetoxy-5-[6-(2,2-diphenylethylamino)-2-[(2E)-2-(phenylcarbamoylimino)hydrazino]purin-9-yl]tetrahydrofuran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3R,4R,5R)-3,4-diacetyloxy-5-[2-[(2E)-2-[anilino(oxo)methyl]iminohydrazinyl]-6-(2,2-diphenylethylamino)-9-purinyl]-2-oxolanyl]methyl ester IUPAC Name: [(2R,3R,4R,5R)-3,4-diacetyloxy-5-[6-(2,2-diphenylethylamino)-2-[(2E)-2-(phenylcarbamoylimino)hydrazinyl]purin-9-yl]oxolan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3R,4R,5R)-3,4-diacetoxy-5-[6-(2,2-diphenylethylamino)-2-[(N'E)-N'-(phenylcarbamoylimino)hydrazino]purin-9-yl]tetrahydrofuran-2-yl]methyl ester Formula: C37H37N9O8 MolecularWeight: 735.74518

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(C(C(O1)N2C=NC3=C2N=C(N=C3NCC(C4=CC=CC=C4)C5=CC=CC=C5)NN=NC(=O)NC6=CC=CC=C6)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C2N=C(N=C3NCC(C4=CC=CC=C4)C5=CC=CC=C5)N/N=N/C(=O)NC6=CC=CC=C6)OC(=O)C)OC(=O)C

InChI

InChI=1S/C37H37N9O8/c1-22(47)51-20-29-31(52-23(2)48)32(53-24(3)49)35(54-29)46-21-39-30-33(38-19-28(25-13-7-4-8-14-25)26-15-9-5-10-16-26)41-36(42-34(30)46)43-45-44-37(50)40-27-17-11-6-12-18-27/h4-18,21,28-29,31-32,35H,19-20H2,1-3H3,(H3,38,40,41,42,43,44,50)/t29-,31-,32-,35-/m1/s1