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]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]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]phenoxy]propylamino]-2-methyl-propanamide CAS Name: 2-methyl-2-[3-[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-[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]phenoxy]propylamino]-2-methyl-propionamide Formula: C26H40N4O8 MolecularWeight: 536.6178

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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=CC=C(C=C3)OCCCNC(C)(C)C(=O)N

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=CC=C(C=C3)OCCCNC(C)(C)C(=O)N

InChI

InChI=1S/C26H40N4O8/c1-14(2)19-17(23(30-29-19)38-24-22(34)21(33)20(32)18(13-31)37-24)12-15-6-8-16(9-7-15)36-11-5-10-28-26(3,4)25(27)35/h6-9,14,18,20-22,24,28,31-34H,5,10-13H2,1-4H3,(H2,27,35)(H,29,30)/t18-,20-,21+,22-,24+/m1/s1