AC1MHFJ9
S-phenyl 3-(1-phenylethyl)imidazole-4-carbothioate;hydrochloride
Also Known As: 4-Imidazolethiocarboxylic acid, 3-(alpha-methylbenzyl)-, S-phenyl ester, hydrochloride, (-)-|4-Imidazolethiocarboxylic acid, 3-(alpha-methylbenzyl)-, S-phenyl ester, hydrochloride, (+-)-|(+)-S-Phenyl, 3-(alpha-methylbenzyl)-4-imidazolethiocarboxylate hydrochloride|(+-)-S-Phenyl, 3-(alpha-methylbenzyl)-4-imidazolethiocarboxylate hydrochloride|(-)-S-Phenyl, 3-(alpha-methylbenzyl)-4-imidazolethiocarboxylate hydrochloride|4-Imidazolethiocarboxylic acid, 3-(alpha-methylbenzyl)-, S-phenyl ester, hydrochloride, (+)-|S-phenyl 3-(1-phenylethyl)imidazole-4-carbothioate hydrochloride|S-Phenyl 1-(1-phenylethyl)-1H-imidazole-5-carbothioate--hydrogen chloride (1/1)|1H-Imidazole-5-carbothioic acid, 1-(1-phenylethyl)-, S-phenyl ester, monohydrochloride, ()-|1H-Imidazole-5-carbothioic acid, 1-(1-phenylethyl)-, S-phenyl ester, monohydrochloride, (-)-|1H-Imidazole-5-carbothioic acid, 1-(1-phenylethyl)-, S-phenyl ester, monohydrochloride, (.+.)-
| Molecular Formula | C18H17ClN2OS |
|---|---|
| Molecular Weight | 344.075 g/mol |
| LogP | 4.8467 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 344.075 |
| Monoisotopic Mass | 344.075 |
| Heavy Atoms | 23 |
| Complexity | 758.96234 |
Chemical Identifiers
| CAS Number | 66641-87-0 |
|---|---|
| SMILES | CC(C1=CC=CC=C1)N2C=NC=C2C(=O)SC3=CC=CC=C3.Cl |
Product Overview
AC1MHFJ9 (CAS 66641-87-0), with molecular formula C18H17ClN2OS and molecular weight 344.075 g/mol. IUPAC: S-phenyl 3-(1-phenylethyl)imidazole-4-carbothioate;hydrochloride.
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