9-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-4-[(2-sulfanylidene-1,3,2$l^{5}-dithiaphospholan-2-yl)oxy]oxolan-2-yl]-2-[(E)-(1-methylpyrrolidin-2-ylidene)amino]-3H-purin-6-one

Systemtic Name: 9-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-4-[(2-sulfanylidene-1,3,2$l^{5}-dithiaphospholan-2-yl)oxy]oxolan-2-yl]-2-[(E)-(1-methylpyrrolidin-2-ylidene)amino]-3H-purin-6-one Openeye Name: 9-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-4-[(2-thioxo-1,3,2$l^{5}-dithiaphospholan-2-yl)oxy]tetrahydrofuran-2-yl]-2-[(E)-(1-methylpyrrolidin-2-ylidene)amino]-3H-purin-6-one CAS Name: 9-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-[(2-sulfanylidene-1,3,2$l^{5}-dithiaphospholan-2-yl)oxy]-2-oxolanyl]-2-[(E)-(1-methyl-2-pyrrolidinylidene)amino]-3H-purin-6-one IUPAC Name: 9-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-[(2-sulfanylidene-1,3,2$l^{5}-dithiaphospholan-2-yl)oxy]oxolan-2-yl]-2-[(E)-(1-methylpyrrolidin-2-ylidene)amino]-3H-purin-6-one Traditional Name: 9-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-4-[(2-thioxo-1,3,2$l^{5}-dithiaphospholan-2-yl)oxy]tetrahydrofuran-2-yl]-2-[(E)-(1-methylpyrrolidin-2-ylidene)amino]-3H-purin-6-one Formula: C38H41N6O6PS3 MolecularWeight: 804.937501

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC1=NC2=NC(=O)C3=C(N2)N(C=N3)C4CC(C(O4)COC(C5=CC=CC=C5)(C6=CC=C(C=C6)OC)C7=CC=C(C=C7)OC)OP8(=S)SCCS8

Isomeric SMILES

CN\1CCC/C1=N\C2=NC(=O)C3=C(N2)N(C=N3)[C@H]4C[C@@H]([C@H](O4)COC(C5=CC=CC=C5)(C6=CC=C(C=C6)OC)C7=CC=C(C=C7)OC)OP8(=S)SCCS8

InChI

InChI=1S/C38H41N6O6PS3/c1-43-19-7-10-32(43)40-37-41-35-34(36(45)42-37)39-24-44(35)33-22-30(50-51(52)53-20-21-54-51)31(49-33)23-48-38(25-8-5-4-6-9-25,26-11-15-28(46-2)16-12-26)27-13-17-29(47-3)18-14-27/h4-6,8-9,11-18,24,30-31,33H,7,10,19-23H2,1-3H3,(H,41,42,45)/b40-32+/t30-,31+,33+/m0/s1