Chem
J-GLOBAL ID:200907036665260237
Nikkaji number:J2.133.277A
4-[[(2Z)-5-(3-Methyl-2,3-dihydrobenzothiazole-2-ylidene)-3-ethyl-4-oxothiazolidine-2-ylidene]methyl]-1-methylpyridinium
4-[[(2Z)-5-(3-メチル-2,3-ジヒドロベンゾチアゾール-2-イリデン)-3-エチル-4-オキソチアゾリジン-2-イリデン]メチル]-1-メチルピリジニウム
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Substance type:
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
Molecular formula:
C20 H20 N2 [N+]OS2
Molecular formula furigana:
C20-H20-N3-O-S2
Molecular weight:
382.520
InChI:
InChI=1S/C20H20N3OS2/c1-4-23-17(13-14-9-11-21(2)12-10-14)26-18(19(23)24)20-22(3)15-7-5-6-8-16(15)25-20/h5-13H,4H2,1-3H3/q+1
InChI key:
ZITVAWHQQIERHQ-UHFFFAOYSA-N
SMILES:
CCn1/c(=C/c2cc[n+](C)cc2)/sc(=c2sc3ccccc3n2C)c1=O
Systematic name (3):
4-[[(2Z)-5-(3-メチル-2,3-ジヒドロベンゾチアゾール-2-イリデン)-3-エチル-4-オキソチアゾリジン-2-イリデン]メチル]-1-メチルピリジニウム
4-{[(2Z)-3-エチル-5-(3-メチル-2,3-ジヒドロ-1,3-ベンゾチアゾール-2-イリデン)-4-オキソ-1,3-チアゾリジン-2-イリデン]メチル}-1-メチルピリジン-1-イウム
4-{[(2Z)-3-ethyl-5-(3-methyl-2,3-dihydro-1,3-benzothiazol-2-ylidene)-4-oxo-1,3-thiazolidin-2-ylidene]methyl}-1-methylpyridin-1-ium
Other name (1):
4-[[(2Z)-5-(3-Methyl-2,3-dihydrobenzothiazole-2-ylidene)-3-ethyl-4-oxothiazolidine-2-ylidene]methyl]-1-methylpyridinium
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