(2S,3R,4R,5S,6R)-2-[4-chloranyl-3-[[4-[2-(6-methylpyridazin-3-yl)ethynyl]phenyl]methyl]phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol

Systemtic Name: (2S,3R,4R,5S,6R)-2-[4-chloranyl-3-[[4-[2-(6-methylpyridazin-3-yl)ethynyl]phenyl]methyl]phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol Openeye Name: (2S,3R,4R,5S,6R)-2-[4-chloro-3-[[4-[2-(6-methylpyridazin-3-yl)ethynyl]phenyl]methyl]phenyl]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol CAS Name: (2S,3R,4R,5S,6R)-2-[4-chloro-3-[[4-[2-(6-methyl-3-pyridazinyl)ethynyl]phenyl]methyl]phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol IUPAC Name: (2S,3R,4R,5S,6R)-2-[4-chloro-3-[[4-[2-(6-methylpyridazin-3-yl)ethynyl]phenyl]methyl]phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol Traditional Name: (2S,3R,4R,5S,6R)-2-[4-chloro-3-[4-[2-(6-methylpyridazin-3-yl)ethynyl]benzyl]phenyl]-6-methylol-tetrahydropyran-3,4,5-triol Formula: C26H25ClN2O5 MolecularWeight: 480.9401

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(C=C1)C#CC2=CC=C(C=C2)CC3=C(C=CC(=C3)C4C(C(C(C(O4)CO)O)O)O)Cl

Isomeric SMILES

CC1=NN=C(C=C1)C#CC2=CC=C(C=C2)CC3=C(C=CC(=C3)[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)Cl

InChI

InChI=1S/C26H25ClN2O5/c1-15-2-9-20(29-28-15)10-7-16-3-5-17(6-4-16)12-19-13-18(8-11-21(19)27)26-25(33)24(32)23(31)22(14-30)34-26/h2-6,8-9,11,13,22-26,30-33H,12,14H2,1H3/t22-,23-,24+,25-,26+/m1/s1