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(Q82501371)
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English
4-(3-Phenylpropyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
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
219.083018416
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₁H₁₃N₃S
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canonical SMILES
C1=CC=C(C=C1)CCCN2C=NNC2=S
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Identifiers
InChI
InChI=1S/C11H13N3S/c15-11-13-12-9-14(11)8-4-7-10-5-2-1-3-6-10/h1-3,5-6,9H,4,7-8H2,(H,13,15)
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InChIKey
AXVLLYOMSWQUSN-UHFFFAOYSA-N
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CAS Registry Number
642075-30-7
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PubChem CID
20225718
1 reference
matched by identifier from
InChIKey
InChIKey
AXVLLYOMSWQUSN-UHFFFAOYSA-N
UniChem compound ID
25063923
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID70603820
1 reference
matched by identifier from
InChIKey
InChIKey
AXVLLYOMSWQUSN-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID40554577
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