| SpectraBase Spectrum ID |
Dt9SgYtMMuP |
| Name |
Ergoline-6-carbothioamide, 8-[(methylthio)methyl]-, (8.beta.)- |
| CAS Registry Number |
98988-35-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H21N3S2 |
| InChI |
InChI=1S/C17H21N3S2/c1-22-9-10-5-13-12-3-2-4-14-16(12)11(7-19-14)6-15(13)20(8-10)17(18)21/h2-4,7,10,13,15,19H,5-6,8-9H2,1H3,(H2,18,21)/t10-,13-,15-/m1/s1 |
| InChIKey |
QVAQTQHGFNCOTG-WDBKCZKBSA-N |
| Molecular Weight |
331.496 g/mol |
| SMILES |
[nH]1c2cccc3[C@@]4([C@](N(C(=S)N)C[C@@](C4)(CSC)[H])(Cc(c23)c1)[H])[H] |
| SPLASH |
splash10-001i-0029000000-45c5385af82e4922a633 |
| Source of Spectrum |
H-68-1031-5 |
| Synonyms |
Indolo[4,3-fg]quinoline, ergoline-6-carbothioamide deriv.
(5R,8R,10R)-8-(methylthiomethyl)ergoline-6-thiocarboxamide
(8beta)-8-[(methylsulfanyl)methyl]ergoline-6-carbothioamide
(6aR,9R,10aR)-9-(methylsulfanylmethyl)-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-7-carbothioamide |
| Wiley ID |
1328652 |
![Ergoline-6-carbothioamide, 8-[(methylthio)methyl]-, (8.beta.)-](/api/spectrum/Dt9SgYtMMuP/structure.png?h=300&w=458 "Ergoline-6-carbothioamide, 8-[(methylthio)methyl]-, (8.beta.)-")
