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Details

Stereochemistry ACHIRAL
Molecular Formula C18H18Cl2N2O3S
Molecular Weight 413.318
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-[[4-[3-(4,5-Dichloro-2-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl]sulfonyl]ethanol

SMILES

CC1=CC(Cl)=C(Cl)C=C1C2=NN(CC2)C3=CC=C(C=C3)S(=O)(=O)CCO

InChI

InChIKey=ZSKBQNJOXKPYHR-UHFFFAOYSA-N
InChI=1S/C18H18Cl2N2O3S/c1-12-10-16(19)17(20)11-15(12)18-6-7-22(21-18)13-2-4-14(5-3-13)26(24,25)9-8-23/h2-5,10-11,23H,6-9H2,1H3

HIDE SMILES / InChI

Molecular Formula C18H18Cl2N2O3S
Molecular Weight 413.318
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:42:11 GMT 2023
Edited
by admin
on Sat Dec 16 12:42:11 GMT 2023
Record UNII
8XJF4XDT6G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-[[4-[3-(4,5-Dichloro-2-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl]sulfonyl]ethanol
Systematic Name English
Ethanol, 2-[[4-[3-(4,5-dichloro-2-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]phenyl]sulfonyl]-
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
252-562-3
Created by admin on Sat Dec 16 12:42:11 GMT 2023 , Edited by admin on Sat Dec 16 12:42:11 GMT 2023
PRIMARY
PUBCHEM
3015777
Created by admin on Sat Dec 16 12:42:11 GMT 2023 , Edited by admin on Sat Dec 16 12:42:11 GMT 2023
PRIMARY
FDA UNII
8XJF4XDT6G
Created by admin on Sat Dec 16 12:42:11 GMT 2023 , Edited by admin on Sat Dec 16 12:42:11 GMT 2023
PRIMARY
EPA CompTox
DTXSID50188928
Created by admin on Sat Dec 16 12:42:11 GMT 2023 , Edited by admin on Sat Dec 16 12:42:11 GMT 2023
PRIMARY
CAS
35441-12-4
Created by admin on Sat Dec 16 12:42:11 GMT 2023 , Edited by admin on Sat Dec 16 12:42:11 GMT 2023
PRIMARY