CAS Registry Number®
145821-59-6
CAS Name
Tiagabine hydrochloride
Molecular Formula
C20H25NO2S2.ClH
Compound Properties
-
Melting Point (1)
192 °C (decomp)
Source(s)
- (1) Drugs – Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)
Other Names and Identifiers
InChI
InChI=1S/C20H25NO2S2.ClH/c1-14-7-11-24-18(14)17(19-15(2)8-12-25-19)6-4-10-21-9-3-5-16(13-21)20(22)23;/h6-8,11-12,16H,3-5,9-10,13H2,1-2H3,(H,22,23);1H/t16-;/m1./s1
InChIKey
InChIKey=YUKARLAABCGMCN-PKLMIRHRSA-N
SMILES
C(=CCCN1C[C@H](C(O)=O)CCC1)(C2=C(C)C=CS2)C3=C(C)C=CS3.Cl
Canonical SMILES
Cl.O=C(O)C1CN(CCC=C(C=2SC=CC2C)C=3SC=CC3C)CCC1
Other Names for this Substance
- 3-Piperidinecarboxylic acid, 1-[4,4-bis(3-methyl-2-thienyl)-3-buten-1-yl]-, hydrochloride (1:1), (3R)-
- 3-Piperidinecarboxylic acid, 1-[4,4-bis(3-methyl-2-thienyl)-3-butenyl]-, hydrochloride, (R)-
- 3-Piperidinecarboxylic acid, 1-[4,4-bis(3-methyl-2-thienyl)-3-butenyl]-, hydrochloride, (3R)-
- Tiagabine hydrochloride
- Abbott 70569.1
- Abbott 70569 hydrochloride
- ABT 569
- NO 05-0328
- NNC 05-0328
- Tiabex
- Gabitril
- (3R)-1-[4,4-Bis(3-methylthien-2-yl)-3-butenyl]piperidine-3-carboxylic acid hydrochloride
- (3R)-1-[4,4-Bis(3-methylthiophen-2-yl)but-3-en-1-yl]piperidine-3-carboxylic acid hydrochloride