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Substance Name: 2-Thiopheneacetic acid, alpha-2-cyclohexen-1-yl-, 2-diisopropylaminoethyl ester, hydrochloride
RN: 102370-97-8
InChIKey: IMMNYBXOHBGVBQ-UHFFFAOYSA-N
Classification Code
- Drug / Therapeutic Agent
Molecular Formula
- C20-H31-N-O2-S.Cl-H
Molecular Weight
- 385.9968
Names and Synonyms
Synonyms
- alpha-2-Cyclohexen-1-yl-2-thiopheneacetic acid 2-diisopropylaminoethyl ester hydrochloride
- beta-Diisopropylaminoethyl alpha-(2-cyclohexenyl)-alpha-(2-thienyl)-acetate hydrochloride
Systematic Name
- 2-Thiopheneacetic acid, alpha-2-cyclohexen-1-yl-, 2-diisopropylaminoethyl ester, hydrochloride
Registry Numbers
CAS Registry Number
- 102370-97-8
System Generated Number
- 0102370978
Molecular Formulas
Molecular Formula
- C20-H31-N-O2-S.Cl-H
Molecular Formula Fragments
- C20-H31-N-O2-S
- Cl-H
- COMPONENT
Structure Descriptors
InChI
1S/C20H31NO2S.ClH/c1-15(2)21(16(3)4)12-13-23-20(22)19(18-11-8-14-24-18)17-9-6-5-7-10-17;/h6,8-9,11,14-17,19H,5,7,10,12-13H2,1-4H3;1HInChIKey
IMMNYBXOHBGVBQ-UHFFFAOYSA-NSmiles
C([C@@H](c1cccs1)Toxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intravenous | 62800ug/kg (62.8mg/kg) | Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 45, Pg. 578, 1956. | |
mouse | LD50 | oral | 1450mg/kg (1450mg/kg) | Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 45, Pg. 578, 1956. |