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(2R,6S)-clopamide
chemical compound
3-ethyl-4-methyl-N-[2-(4-{[(trans-4-methylcyclohexyl)carbamoyl]sulfamoyl}phenyl)ethyl]-2-oxo-2,5-dihydro-1H-pyrrole-1-carboxamide
4-chloro-N-[(2S,6R)-2,6-dimethyl-1-piperidinyl]-3-sulfamoylbenzamide
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Statements
instance of
type of chemical entity
0 references
subclass of
(2RS,6RS)-clopamide
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mass
345.09139017999996
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₁₄H₂₀ClN₃O₃S
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC1CCCC(N1NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N)C
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isomeric SMILES
C[C@@H]1CCC[C@@H](N1NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N)C
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different from
(2RS,6RS)-clopamide
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Identifiers
InChI
InChI=1S/C14H20ClN3O3S/c1-9-4-3-5-10(2)18(9)17-14(19)11-6-7-12(15)13(8-11)22(16,20)21/h6-10H,3-5H2,1-2H3,(H,17,19)(H2,16,20,21)/t9-,10+
1 reference
stated in
ChEBI release 2021-03-01
InChIKey
LBXHRAWDUMTPSE-AOOOYVTPSA-N
1 reference
stated in
ChEBI release 2021-03-01
CAS Registry Number
636-54-4
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
ChemSpider ID
11980
0 references
PubChem CID
12492
1 reference
stated in
ChEBI release 2021-03-01
ChEBI ID
94521
mapping relation type
exact match
1 reference
stated in
ChEBI release 2021-03-01
UniChem compound ID
849622
1 reference
stated in
UniChem
Probes And Drugs ID
PD013136
0 references
DrugCentral ID
706
1 reference
stated in
UniChem
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