N-[1-[(2R,3R,4R,5R)-5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-4-[2-cyanoethoxy-[di(propan-2-yl)amino]phosphanyl]oxy-3-methyl-3-(oxan-2-yloxy)oxolan-2-yl]-2-oxidanylidene-pyrimidin-4-yl]benzamide

Systemtic Name: N-[1-[(2R,3R,4R,5R)-5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-4-[2-cyanoethoxy-[di(propan-2-yl)amino]phosphanyl]oxy-3-methyl-3-(oxan-2-yloxy)oxolan-2-yl]-2-oxidanylidene-pyrimidin-4-yl]benzamide Openeye Name: N-[1-[(2R,3R,4R,5R)-5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-4-[2-cyanoethoxy-(diisopropylamino)phosphanyl]oxy-3-methyl-3-tetrahydropyran-2-yloxy-tetrahydrofuran-2-yl]-2-oxo-pyrimidin-4-yl]benzamide CAS Name: N-[1-[(2R,3R,4R,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-[2-cyanoethoxy-[di(propan-2-yl)amino]phosphino]oxy-3-methyl-3-(2-oxanyloxy)-2-oxolanyl]-2-oxo-4-pyrimidinyl]benzamide IUPAC Name: N-[1-[(2R,3R,4R,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-[2-cyanoethoxy-[di(propan-2-yl)amino]phosphanyl]oxy-3-methyl-3-(oxan-2-yloxy)oxolan-2-yl]-2-oxopyrimidin-4-yl]benzamide Traditional Name: N-[1-[(2R,3R,4R,5R)-5-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]-4-[2-cyanoethoxy-(diisopropylamino)phosphino]oxy-3-methyl-3-tetrahydropyran-2-yloxy-tetrahydrofuran-2-yl]-2-keto-pyrimidin-4-yl]benzamide Formula: C52H62N5O10P MolecularWeight: 948.049941

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(C)C)P(OCCC#N)OC1C(OC(C1(C)OC2CCCCO2)N3C=CC(=NC3=O)NC(=O)C4=CC=CC=C4)COC(C5=CC=CC=C5)(C6=CC=C(C=C6)OC)C7=CC=C(C=C7)OC

Isomeric SMILES

CC(C)N(C(C)C)P(OCCC#N)O[C@@H]1[C@H](O[C@H]([C@]1(C)OC2CCCCO2)N3C=CC(=NC3=O)NC(=O)C4=CC=CC=C4)COC(C5=CC=CC=C5)(C6=CC=C(C=C6)OC)C7=CC=C(C=C7)OC

InChI

InChI=1S/C52H62N5O10P/c1-36(2)57(37(3)4)68(64-34-16-31-53)67-47-44(35-63-52(39-19-12-9-13-20-39,40-22-26-42(60-6)27-23-40)41-24-28-43(61-7)29-25-41)65-49(51(47,5)66-46-21-14-15-33-62-46)56-32-30-45(55-50(56)59)54-48(58)38-17-10-8-11-18-38/h8-13,17-20,22-30,32,36-37,44,46-47,49H,14-16,21,33-35H2,1-7H3,(H,54,55,58,59)/t44-,46?,47-,49-,51-,68?/m1/s1