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(Q82663121)
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English
(1E)-2-(3-Ethyl-1,3-benzothiazol-2(3H)-ylidene)-N-phenylethan-1-imine
group of stereoisomers with the chemical formula C₁₇H₁₆N₂S
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Statements
instance of
group of stereoisomers
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subclass of
chemical compound
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mass
280.10341951199996
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₁₆N₂S
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CCN1C(=C/C=N/c2ccccc2)Sc2ccccc21
1 reference
based on heuristic
inferred from InChI
isomeric SMILES
CCN1C(=C/C=N/c2ccccc2)Sc2ccccc21
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C17H16N2S/c1-2-19-15-10-6-7-11-16(15)20-17(19)12-13-18-14-8-4-3-5-9-14/h3-13H,2H2,1H3/b17-12?,18-13+
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InChIKey
QKBQYYCINFPLRE-HIKIFILJSA-N
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CAS Registry Number
93317-48-7
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DSSTox substance ID
DTXSID20723365
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DSSTOX compound identifier
DTXCID10674110
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