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Details

Stereochemistry MIXED
Molecular Formula C14H16N2O3S
Molecular Weight 292.353
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(2-AMINO-1-HYDROXY-2-PHENYLETHYL)BENZENESULFONAMIDE

SMILES

NC(C(O)C1=CC=C(C=C1)S(N)(=O)=O)C2=CC=CC=C2

InChI

InChIKey=WWQLMNLOHJLZOM-UHFFFAOYSA-N
InChI=1S/C14H16N2O3S/c15-13(10-4-2-1-3-5-10)14(17)11-6-8-12(9-7-11)20(16,18)19/h1-9,13-14,17H,15H2,(H2,16,18,19)

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
4-(2-AMINO-1-HYDROXY-2-PHENYLETHYL)BENZENESULFONAMIDE
Systematic Name English
BENZENESULFONAMIDE, 4-(2-AMINO-1-HYDROXY-2-PHENYLETHYL)-
Systematic Name English
VALDECOXIB METABOLITE M6
Common Name English
Code System Code Type Description
FDA UNII
XUV6GHB2UW
Created by admin on Sat Dec 16 15:34:00 GMT 2023 , Edited by admin on Sat Dec 16 15:34:00 GMT 2023
PRIMARY
PUBCHEM
86212053
Created by admin on Sat Dec 16 15:34:00 GMT 2023 , Edited by admin on Sat Dec 16 15:34:00 GMT 2023
PRIMARY
CAS
501093-52-3
Created by admin on Sat Dec 16 15:34:00 GMT 2023 , Edited by admin on Sat Dec 16 15:34:00 GMT 2023
PRIMARY
PARENT (METABOLITE)
Structure of VALDECOXIB
NIH
NCATS
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