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The PubChem CID is 651175.
The molecular formula is C11H17N3O2S.
The synonyms are:1. 462066-86-02. (5-Cyclohexyl-4-methyl-1,2,4-triazol-3-yl-sulfanyl)acetic acid3. 2-[(5-cyclohexyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetic acid4. 2-((5-Cyclohexyl-4-methyl-4H-1,2,4-triazol-3-yl)thio)acetic acid5. MFCD02588700
The molecular weight is 255.34 g/mol.
It was created on June 4, 2005.
It was last modified on December 2, 2023.
The IUPAC name is 2-[(5-cyclohexyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetic acid.
The InChI is InChI=1S/C11H17N3O2S/c1-14-10(8-5-3-2-4-6-8)12-13-11(14)17-7-9(15)16/h8H,2-7H2,1H3,(H,15,16).
The InChIKey is BNHIXPXOCQCHTR-UHFFFAOYSA-N.
The Canonical SMILES is CN1C(=NN=C1SCC(=O)O)C2CCCCC2.
N-[3-(4-Aminophenyl)propyl]-N,N-dimethylamine
1-(3-Fluorophenyl)cyclopentanecarboxylic acid
2-(4-Dimethylamino-benzylamino)-ethanol
(4-Phenylbutyl)methylamine hydrochloride
(3-Dimethylaminomethyl-benzyl)-methyl-amine
2-[(Allylamino)carbonyl]cyclohexanecarboxylic acid
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