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Details

Stereochemistry ACHIRAL
Molecular Formula C16H18ClNOS.ClH
Molecular Weight 344.3007
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 403U76

SMILES

CN(C)Cc1ccccc1Sc2ccc(cc2CO)Cl.Cl

InChI

InChIKey=UTHAGXYCVSCSKS-UHFFFAOYSA-N
InChI=1S/C16H18ClNOS.ClH/c1-18(2)10-12-5-3-4-6-15(12)20-16-8-7-14(17)9-13(16)11-19;/h3-9,19H,10-11H2,1-2H3;1H

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.4609
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C16H18ClNOS
Molecular Weight 307.8398
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 Jun 26 02:08:51 UTC 2021
Edited
by admin
on Sat Jun 26 02:08:51 UTC 2021
Record UNII
55PIV9HW64
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
403U76
Common Name English
BENZENEMETHANOL, 5-CHLORO-2-((2-((DIMETHYLAMINO)METHYL)PHENYL)THIO)-, HYDROCHLORIDE
Systematic Name English
5-CHLORO-2-((2-((DIMETHYLAMINO)METHYL)PHENYL)THIO)BENZYL ALCOHOL HYDROCHLORIDE
Systematic Name English
Code System Code Type Description
PUBCHEM
9819495
Created by admin on Sat Jun 26 02:08:51 UTC 2021 , Edited by admin on Sat Jun 26 02:08:51 UTC 2021
PRIMARY
CAS
133884-21-6
Created by admin on Sat Jun 26 02:08:51 UTC 2021 , Edited by admin on Sat Jun 26 02:08:51 UTC 2021
PRIMARY
FDA UNII
55PIV9HW64
Created by admin on Sat Jun 26 02:08:51 UTC 2021 , Edited by admin on Sat Jun 26 02:08:51 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE