CAS Registry Number®
66104-23-2
CAS Name
Pergolide mesylate
Molecular Formula
C19H26N2S.CH4O3S
Compound Properties
-
Melting Point (1)
225 °C
Source(s)
- (1) Drugs – Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)
Other Names and Identifiers
InChI
InChI=1S/C19H26N2S.CH4O3S/c1-3-7-21-11-13(12-22-2)8-16-15-5-4-6-17-19(15)14(10-20-17)9-18(16)21;1-5(2,3)4/h4-6,10,13,16,18,20H,3,7-9,11-12H2,1-2H3;1H3,(H,2,3,4)/t13-,16-,18-;/m1./s1
InChIKey
InChIKey=UWCVGPLTGZWHGS-ZORIOUSZSA-N
SMILES
C(CC)N1[C@]2([C@@](C=3C=4C(C2)=CNC4C=CC3)(C[C@@H](CSC)C1)[H])[H].S(C)(=O)(=O)O
Canonical SMILES
O=S(=O)(O)C.S(C)CC1CN(CCC)C2CC3=CNC4=CC=CC(=C43)C2C1
Other Names for this Substance
- Ergoline, 8-[(methylthio)methyl]-6-propyl-, (8β)-, monomethanesulfonate
- Indolo[4,3-fg]quinoline, ergoline deriv.
- Pergolide mesylate
- LY 127809
- Pergolide methanesulfonate
- Permax
- Celance
- NSC 319773
Deleted or Replaced CAS Registry Numbers
138932-34-0
