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(Q6456076)
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English
L-694,247
chemical compound
N-[4-[[5-[3-(2-Aminoethyl)-1H-indol-5-yl]-1,2,4-oxadiazol-3-yl]methyl]phenyl]-methanesulfonamide
L 694247
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
411.136510532
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₂₁N₅O₃S
1 reference
imported from Wikimedia project
English Wikipedia
canonical SMILES
CS(=O)(=O)Nc1ccc(cc1)Cc2nc(on2)c3ccc4c(c3)c(c[nH]4)CCN
0 references
Identifiers
InChI
InChI=1S/C20H21N5O3S/c1-29(26,27)25-16-5-2-13(3-6-16)10-19-23-20(28-24-19)14-4-7-18-17(11-14)15(8-9-21)12-22-18/h2-7,11-12,22,25H,8-10,21H2,1H3
0 references
InChIKey
HKXMQLISPYELRD-UHFFFAOYSA-N
1 reference
stated in
ChEBI release 2020-09-01
CAS Registry Number
137403-12-4
1 reference
InChIKey
HKXMQLISPYELRD-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
8 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=137403-12-4
PubChem CID
132059
0 references
ChEBI ID
92341
mapping relation type
exact match
2 references
stated in
ChEBI release 2019-10-02
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C20H21N5O3S/c1-29(26,27)25-16-5-2-13(3-6-16)10-19-23-20(28-24-19)14-4-7-18-17(11-14)15(8-9-21)12-22-18/h2-7,11-12,22,25H,8-10,21H2,1H3
ChEMBL ID
CHEMBL39317
0 references
UniChem compound ID
152747
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20160175
1 reference
stated in
Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard
DSSTOX compound identifier
DTXCID4082666
0 references
Guide to Pharmacology Ligand ID
15
1 reference
stated in
IUPHAR/BPS Guide to PHARMACOLOGY
retrieved
5 February 2021
Human Metabolome Database ID
HMDB0260308
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
HKXMQLISPYELRD-UHFFFAOYSA-N
UNII
PZ5DP5EN56
1 reference
matched by identifier from
InChIKey
InChIKey
HKXMQLISPYELRD-UHFFFAOYSA-N
Probes And Drugs ID
PD035704
0 references
Freebase ID
/m/0hzn77z
0 references
Microsoft Academic ID
2776102980
0 references
Sitelinks
Wikipedia
(4 entries)
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azbwiki
ال-۶۹۴٬۲۴۷
enwiki
L-694247
fawiki
ال-۶۹۴٬۲۴۷
srwiki
L-694247
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Wikinews
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