1-(4-Methoxyphenyl)-1H-imidazole-2-thiol

C₁₀H₁₀N₂OSCAS 17452-14-1206.26 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₀H₁₀N₂OS
Molar mass: 206.26 g/mol
Exact mass: 206.0514 Da
logP: 2.54Crippen estimate
Polar surface area: 29.9 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 2

Identifiers

CAS number

17452-14-1

SMILES

COC1=CC=C(C=C1)N2C=CNC2=S

InChIKey

LIEBCNQPMNARMP-UHFFFAOYSA-N

InChI

InChI=1S/C10H10N2OS/c1-13-9-4-2-8(3-5-9)12-7-6-11-10(12)14/h2-7H,1H3,(H,11,14)

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Names and synonyms

1 names

1-(4-Methoxyphenyl)imidazoline-2-thione

Work with 1-(4-Methoxyphenyl)-1H-imidazole-2-thiol

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1-(4-Methoxyphenyl)-1H-imidazole10040-95-643 % similar 1,4-Dimethoxybenzene150-78-740 % similar 4-Methoxyphenol150-76-537 % similar Anisyl alcohol105-13-534 % similar (4-Methoxyphenyl)boronic acid5720-07-034 % similar 4-Methoxy-α-(4-methoxyphenyl)benzenemethanol728-87-034 % similar 6-Methoxyindole3189-13-734 % similar 4-Fluoroanisole459-60-933 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2-Amino-4-(4-methoxyphenyl)thiazole2104-04-3 5-Methyl-3-phenyl-2-thioxo-4-imidazolidinone4333-19-1 2-[(2-Furanylmethyl)thio]-3-methylpyrazine59303-07-0

Elsewhere

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