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Details

Stereochemistry ACHIRAL
Molecular Formula C12H12FN3OS.ClH
Molecular Weight 301.768
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RO-41-1049 HYDROCHLORIDE

SMILES

Cl.NCCNC(=O)C1=C(SC=N1)C2=CC(F)=CC=C2

InChI

InChIKey=RRNSPXUFTKJIEZ-UHFFFAOYSA-N
InChI=1S/C12H12FN3OS.ClH/c13-9-3-1-2-8(6-9)11-10(16-7-18-11)12(17)15-5-4-14;/h1-3,6-7H,4-5,14H2,(H,15,17);1H

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C12H12FN3OS
Molecular Weight 265.307
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Increased density of catalytic sites and expression of brain monoamine oxidase A in humans with hepatic encephalopathy.
1997 Mar
Differential substrate specificity of monoamine oxidase in the rat heart and renal cortex.
2003 Jul 11
MAO-A-induced mitogenic signaling is mediated by reactive oxygen species, MMP-2, and the sphingolipid pathway.
2007 Jul 1
Up-regulation of the isoenzymes MAO-A and MAO-B in the human basal ganglia and pons in Huntington's disease revealed by quantitative enzyme radioautography.
2011 Jan 25
Substance Class Chemical
Created
by admin
on Sat Dec 16 10:55:18 GMT 2023
Edited
by admin
on Sat Dec 16 10:55:18 GMT 2023
Record UNII
19Z49HUF4G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
RO-41-1049 HYDROCHLORIDE
Common Name English
4-THIAZOLECARBOXAMIDE, N-(2-AMINOETHYL)-5-(3-FLUOROPHENYL)-, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
CAS
127917-66-2
Created by admin on Sat Dec 16 10:55:18 GMT 2023 , Edited by admin on Sat Dec 16 10:55:18 GMT 2023
PRIMARY
FDA UNII
19Z49HUF4G
Created by admin on Sat Dec 16 10:55:18 GMT 2023 , Edited by admin on Sat Dec 16 10:55:18 GMT 2023
PRIMARY
PUBCHEM
5311308
Created by admin on Sat Dec 16 10:55:18 GMT 2023 , Edited by admin on Sat Dec 16 10:55:18 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY