Mitratapide

CAS Registry Number®

179602-65-4

CAS Name

Mitratapide

Molecular Formula

C36H41ClN8O4S

Molecular Mass

717.28

Cite this Page

Mitratapide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=179602-65-4 (retrieved 2024-11-22) (CAS RN: 179602-65-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C36H41ClN8O4S/c1-4-26(2)45-35(46)44(25-39-45)31-11-9-29(10-12-31)42-17-19-43(20-18-42)30-13-15-32(16-14-30)47-21-33-22-48-36(49-33,27-5-7-28(37)8-6-27)23-50-34-40-38-24-41(34)3/h5-16,24-26,33H,4,17-23H2,1-3H3/t26-,33-,36-/m1/s1

InChIKey

InChIKey=HQSRVYUCBOCBLY-XOOFNSLWSA-N

SMILES

C(SC=1N(C)C=NN1)[C@@]2(O[C@H](COC3=CC=C(C=C3)N4CCN(CC4)C5=CC=C(C=C5)N6C(=O)N([C@@H](CC)C)N=C6)CO2)C7=CC=C(Cl)C=C7

Canonical SMILES

O=C1N(N=CN1C2=CC=C(C=C2)N3CCN(C4=CC=C(OCC5OC(OC5)(C6=CC=C(Cl)C=C6)CSC7=NN=CN7C)C=C4)CC3)C(C)CC

Other Names for this Substance

  • 3H-1,2,4-Triazol-3-one, 4-[4-[4-[4-[[(2S,4R)-2-(4-chlorophenyl)-2-[[(4-methyl-4H-1,2,4-triazol-3-yl)thio]methyl]-1,3-dioxolan-4-yl]methoxy]phenyl]-1-piperazinyl]phenyl]-2,4-dihydro-2-[(1R)-1-methylpropyl]-
  • 3H-1,2,4-Triazol-3-one, 4-[4-[4-[4-[[2-(4-chlorophenyl)-2-[[(4-methyl-4H-1,2,4-triazol-3-yl)thio]methyl]-1,3-dioxolan-4-yl]methoxy]phenyl]-1-piperazinyl]phenyl]-2,4-dihydro-2-(1-methylpropyl)-, [2S-[2α,4α(S*)]]-
  • 4-[4-[4-[4-[[(2S,4R)-2-(4-Chlorophenyl)-2-[[(4-methyl-4H-1,2,4-triazol-3-yl)thio]methyl]-1,3-dioxolan-4-yl]methoxy]phenyl]-1-piperazinyl]phenyl]-2,4-dihydro-2-[(1R)-1-methylpropyl]-3H-1,2,4-triazol-3-one
  • Mitratapide
  • R 103757

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration