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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H24N2O4S
Molecular Weight 388.481
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ACT-462206

SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)NC3=CC(C)=CC(C)=C3

InChI

InChIKey=NHPQGZOBHSVTAQ-IBGZPJMESA-N
InChI=1S/C20H24N2O4S/c1-14-11-15(2)13-16(12-14)21-20(23)19-5-4-10-22(19)27(24,25)18-8-6-17(26-3)7-9-18/h6-9,11-13,19H,4-5,10H2,1-3H3,(H,21,23)/t19-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
ACT-462206
Common Name English
2-PYRROLIDINECARBOXAMIDE, N-(3,5-DIMETHYLPHENYL)-1-((4-METHOXYPHENYL)SULFONYL)-, (2S)-
Systematic Name English
(2S)-N-(3,5-DIMETHYLPHENYL)-1-((4-METHOXYPHENYL)SULFONYL)-2-PYRROLIDINECARBOXAMIDE
Systematic Name English
Code System Code Type Description
PUBCHEM
40924317
Created by admin on Sat Dec 16 11:52:48 UTC 2023 , Edited by admin on Sat Dec 16 11:52:48 UTC 2023
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MANUFACTURER PRODUCT INFORMATION
ACT-462206
Created by admin on Sat Dec 16 11:52:48 UTC 2023 , Edited by admin on Sat Dec 16 11:52:48 UTC 2023
PRIMARY Tocris Cat. No. 5319: ACT 462206Biological Activity: Potent, dual orexin receptor antagonist (IC50 values are 11 and 60 nM for OX2 and OX1 receptors respectively). Exhibits anxiolytic-like properties in vivo. Brain penetrant.
CAS
1361321-96-1
Created by admin on Sat Dec 16 11:52:48 UTC 2023 , Edited by admin on Sat Dec 16 11:52:48 UTC 2023
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FDA UNII
64ONO62P28
Created by admin on Sat Dec 16 11:52:48 UTC 2023 , Edited by admin on Sat Dec 16 11:52:48 UTC 2023
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