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(Q82142610)
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English
Benzamide, 3,4,5-trimethoxy-N-[[(3-nitrophenyl)amino]thioxomethyl]-
chemical compound
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Statements
instance of
type of chemical entity
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subclass of
chemical compound
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mass
391.0838062639999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₇H₁₇N₃O₆S
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canonical SMILES
COC1=CC(=CC(=C1OC)OC)C(=O)NC(=S)NC2=CC(=CC=C2)[N+](=O)[O-]
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Identifiers
InChI
InChI=1S/C17H17N3O6S/c1-24-13-7-10(8-14(25-2)15(13)26-3)16(21)19-17(27)18-11-5-4-6-12(9-11)20(22)23/h4-9H,1-3H3,(H2,18,19,21,27)
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InChIKey
AIZQFUBGAXWJJX-UHFFFAOYSA-N
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CAS Registry Number
74717-16-1
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PubChem CID
1139135
1 reference
matched by identifier from
InChIKey
InChIKey
AIZQFUBGAXWJJX-UHFFFAOYSA-N
UniChem compound ID
11229257
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90360726
1 reference
matched by identifier from
InChIKey
InChIKey
AIZQFUBGAXWJJX-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID30311777
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