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(Q82757673)
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English
2-{[4-(Thiomorpholine-4-sulfonyl)phenyl]carbamoyl}benzoic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
406.0657136759999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₈H₁₈N₂O₅S₂
0 references
canonical SMILES
C1CSCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3C(=O)O
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Identifiers
InChI
InChI=1S/C18H18N2O5S2/c21-17(15-3-1-2-4-16(15)18(22)23)19-13-5-7-14(8-6-13)27(24,25)20-9-11-26-12-10-20/h1-8H,9-12H2,(H,19,21)(H,22,23)
0 references
InChIKey
YEZCXXCFGZJZRO-UHFFFAOYSA-N
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CAS Registry Number
501700-16-9
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PubChem CID
71366742
1 reference
matched by identifier from
InChIKey
InChIKey
YEZCXXCFGZJZRO-UHFFFAOYSA-N
UniChem compound ID
64158768
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40790094
1 reference
matched by identifier from
InChIKey
InChIKey
YEZCXXCFGZJZRO-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID40740837
0 references
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