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(Q82359398)
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English
N-[(3,4-Dimethoxyphenyl)methyl]-N'-(3-hydroxypropyl)thiourea
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
284.1194635
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₃H₂₀N₂O₃S
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canonical SMILES
COC1=C(C=C(C=C1)CNC(=S)NCCCO)OC
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Identifiers
InChI
InChI=1S/C13H20N2O3S/c1-17-11-5-4-10(8-12(11)18-2)9-15-13(19)14-6-3-7-16/h4-5,8,16H,3,6-7,9H2,1-2H3,(H2,14,15,19)
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InChIKey
DHFAQFQASCPNBZ-UHFFFAOYSA-N
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CAS Registry Number
61290-56-0
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PubChem CID
12622973
1 reference
matched by identifier from
InChIKey
InChIKey
DHFAQFQASCPNBZ-UHFFFAOYSA-N
UniChem compound ID
49726584
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90504709
1 reference
matched by identifier from
InChIKey
InChIKey
DHFAQFQASCPNBZ-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID80455519
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