2-[3-[4-[[3-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-5-propan-2-yl-1H-pyrazol-4-yl]methyl]-3-(oxan-4-yloxy)phenoxy]propylamino]-2-methyl-propanamide

Systemtic Name: 2-[3-[4-[[3-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-5-propan-2-yl-1H-pyrazol-4-yl]methyl]-3-(oxan-4-yloxy)phenoxy]propylamino]-2-methyl-propanamide Openeye Name: 2-[3-[4-[[5-isopropyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-1H-pyrazol-4-yl]methyl]-3-tetrahydropyran-4-yloxy-phenoxy]propylamino]-2-methyl-propanamide CAS Name: 2-methyl-2-[3-[3-(4-oxanyloxy)-4-[[5-propan-2-yl-3-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-1H-pyrazol-4-yl]methyl]phenoxy]propylamino]propanamide IUPAC Name: 2-methyl-2-[3-[3-(oxan-4-yloxy)-4-[[5-propan-2-yl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1H-pyrazol-4-yl]methyl]phenoxy]propylamino]propanamide Traditional Name: 2-[3-[4-[[5-isopropyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-1H-pyrazol-4-yl]methyl]-3-tetrahydropyran-4-yloxy-phenoxy]propylamino]-2-methyl-propionamide Formula: C31H48N4O10 MolecularWeight: 636.73362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=NN1)OC2C(C(C(C(O2)CO)O)O)O)CC3=C(C=C(C=C3)OCCCNC(C)(C)C(=O)N)OC4CCOCC4

Isomeric SMILES

CC(C)C1=C(C(=NN1)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)CC3=C(C=C(C=C3)OCCCNC(C)(C)C(=O)N)OC4CCOCC4

InChI

InChI=1S/C31H48N4O10/c1-17(2)24-21(28(35-34-24)45-29-27(39)26(38)25(37)23(16-36)44-29)14-18-6-7-20(15-22(18)43-19-8-12-41-13-9-19)42-11-5-10-33-31(3,4)30(32)40/h6-7,15,17,19,23,25-27,29,33,36-39H,5,8-14,16H2,1-4H3,(H2,32,40)(H,34,35)/t23-,25-,26+,27-,29+/m1/s1