N'-[1-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-4-oxidanyl-oxolan-2-yl]-3-iodanyl-pyrazolo[3,4-d]pyrimidin-4-yl]-N,N-dimethyl-methanimidamide

Systemtic Name: N'-[1-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-4-oxidanyl-oxolan-2-yl]-3-iodanyl-pyrazolo[3,4-d]pyrimidin-4-yl]-N,N-dimethyl-methanimidamide Openeye Name: N'-[1-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-4-hydroxy-tetrahydrofuran-2-yl]-3-iodo-pyrazolo[3,4-d]pyrimidin-4-yl]-N,N-dimethyl-formamidine CAS Name: N'-[1-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-hydroxy-2-oxolanyl]-3-iodo-4-pyrazolo[3,4-d]pyrimidinyl]-N,N-dimethylmethanimidamide IUPAC Name: N'-[1-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-hydroxyoxolan-2-yl]-3-iodopyrazolo[3,4-d]pyrimidin-4-yl]-N,N-dimethylmethanimidamide Traditional Name: N'-[1-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-4-hydroxy-tetrahydrofuran-2-yl]-3-iodo-pyrazolo[3,4-d]pyrimidin-4-yl]-N,N-dimethyl-formamidine Formula: C34H35IN6O5 MolecularWeight: 734.58337

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C=NC1=C2C(=NC=N1)N(N=C2I)C3CC(C(O3)COC(C4=CC=CC=C4)(C5=CC=C(C=C5)OC)C6=CC=C(C=C6)OC)O

Isomeric SMILES

CN(C)/C=N/C1=C2C(=NC=N1)N(N=C2I)[C@H]3C[C@@H]([C@H](O3)COC(C4=CC=CC=C4)(C5=CC=C(C=C5)OC)C6=CC=C(C=C6)OC)O

InChI

InChI=1S/C34H35IN6O5/c1-40(2)21-38-32-30-31(35)39-41(33(30)37-20-36-32)29-18-27(42)28(46-29)19-45-34(22-8-6-5-7-9-22,23-10-14-25(43-3)15-11-23)24-12-16-26(44-4)17-13-24/h5-17,20-21,27-29,42H,18-19H2,1-4H3/b38-21+/t27-,28+,29+/m0/s1