Chem
J-GLOBAL ID：200907068020720267
Nikkaji number：J1.006.334E
Dimethyl[3-[(4-chlorophenyl)amino]-3-oxopropyl]sulfonium
{2-[(4-クロロフェニル)カルバモイル]エチル}ジメチルスルファニウム
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C11H15ClNO[S+]
Molecular formula furigana： C11-H15-CL-N-O-S
Molecular weight： 244.760
InChI：
InChI=1S/C11H14ClNOS/c1-15(2)8-7-11(14)13-10-5-3-9(12)4-6-10/h3-6H,7-8H2,1-2H3/p+1
InChI key：
ANUNXKMDVHFWRM-UHFFFAOYSA-O
SMILES：
C[S+](C)CCC(=O)Nc1ccc(Cl)cc1
Systematic name (3)：
- ジメチル[3-[(4-クロロフェニル)アミノ]-3-オキソプロピル]スルホニウム
- {2-[(4-クロロフェニル)カルバモイル]エチル}ジメチルスルファニウム
- {2-[(4-chlorophenyl)carbamoyl]ethyl}dimethylsulfanium
- Dimethyl[3-[(4-chlorophenyl)amino]-3-oxopropyl]sulfonium
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