CAS: 60-56-0
名称: 3-methyl-1H-imidazole-2-thione
SMILES:
Cn1ccnc1SMolecular Processing
Molecular formula
C4H6N2S
Molecular weight
114.17
Exact mass
114.0252
XLogP
0.71
TPSA
17.82
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
7
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
30.46
Supplementary Information
InChIKey: PMRYVIKBURPHAH-UHFFFAOYSA-N
同義語
methimazole60-56-0thiamazoleTapazole1-Methyl-1H-imidazole-2-thiol1-Methylimidazole-2-thiolMercazolylMethimazolMercazoleThiamazolThymidazolThymidazoleFavistanMetazoloMercaptazoleMetothyrineBasolanMetothyrinStrumazolThycapzolDanantizolFrentiroxMerkazolilMetotirinThacapzolMercasolylMetizolTiamazol2H-Imidazole-2-thione, 1,3-dihydro-1-methyl-Methylmercaptoimidazole
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