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(Q81990863)
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English
2(1H)-Quinolinethione, 1-ethyl-6-methoxy-
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
219.3043
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₂H₁₃NOS
0 references
canonical SMILES
CCN1C2=C(C=CC1=S)C=C(C=C2)OC
0 references
Identifiers
InChI
InChI=1S/C12H13NOS/c1-3-13-11-6-5-10(14-2)8-9(11)4-7-12(13)15/h4-8H,3H2,1-2H3
0 references
InChIKey
XTCNECLGISWWCO-UHFFFAOYSA-N
0 references
CAS Registry Number
4800-53-7
1 reference
InChIKey
XTCNECLGISWWCO-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=4800-53-7
PubChem CID
78525
1 reference
matched by identifier from
InChIKey
InChIKey
XTCNECLGISWWCO-UHFFFAOYSA-N
UniChem compound ID
16231527
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID5063609
1 reference
matched by identifier from
InChIKey
InChIKey
XTCNECLGISWWCO-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID7040601
0 references
UNII
ZYT6L46J4E
1 reference
matched by identifier from
InChIKey
InChIKey
XTCNECLGISWWCO-UHFFFAOYSA-N
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