Mesulergine

CAS Registry Number®

64795-35-3

CAS Name

Mesulergine

Molecular Formula

C18H26N4O2S

Molecular Mass

362.49

Cite this Page

Mesulergine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=64795-35-3 (retrieved 2024-11-21) (CAS RN: 64795-35-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C18H26N4O2S/c1-20(2)25(23,24)19-13-9-15-14-6-5-7-16-18(14)12(10-21(16)3)8-17(15)22(4)11-13/h5-7,10,13,15,17,19H,8-9,11H2,1-4H3/t13-,15+,17+/m0/s1

InChIKey

InChIKey=JLVHTNZNKOSCNB-YSVLISHTSA-N

SMILES

CN1C2=C3C([C@@]4([C@@](CC3=C1)(N(C)C[C@@H](NS(N(C)C)(=O)=O)C4)[H])[H])=CC=C2

Canonical SMILES

O=S(=O)(NC1CN(C)C2CC3=CN(C4=CC=CC(=C43)C2C1)C)N(C)C

Other Names for this Substance

  • Sulfamide, N′-[(8α)-1,6-dimethylergolin-8-yl]-N,N-dimethyl-
  • Indolo[4,3-fg]quinoline, sulfamide deriv.
  • Ergoline, sulfamide deriv.
  • N′-[(8α)-1,6-Dimethylergolin-8-yl]-N,N-dimethylsulfamide
  • Mesulergine

CAS INSIGHTSTM
Targeted protein degrader structure, illustration