Chem
J-GLOBAL ID：200907071888712881
Nikkaji number：J887.807B
3,6-Dipropanoylbenzothiazol-2(3H)-one
3,6-ジプロパノイルベンゾチアゾール-2(3H)-オン
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： C13H13NO3S
Molecular formula furigana： C13-H13-N-O3-S
Molecular weight： 263.310
InChI：
InChI=1S/C13H13NO3S/c1-3-10(15)8-5-6-9-11(7-8)18-13(17)14(9)12(16)4-2/h5-7H,3-4H2,1-2H3
InChI key：
PPKQMPGSPPSHKB-UHFFFAOYSA-N
SMILES：
CCC(=O)c1ccc2n(C(=O)CC)c(=O)sc2c1
Systematic name (3)：
- 3,6-ジプロパノイルベンゾチアゾール-2(3H)-オン
- 3,6-ジプロパノイル-2,3-ジヒドロ-1,3-ベンゾチアゾール-2-オン
- 3,6-dipropanoyl-2,3-dihydro-1,3-benzothiazol-2-one
- 3,6-Dipropanoylbenzothiazol-2(3H)-one
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