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Details

Stereochemistry ACHIRAL
Molecular Formula C14H14O2S2
Molecular Weight 278.39
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Benzenemethanesulfonothioic acid, S-(phenylmethyl) ester

SMILES

O=S(=O)(CC1=CC=CC=C1)SCC2=CC=CC=C2

InChI

InChIKey=LAVBKIWRWNKSGD-UHFFFAOYSA-N
InChI=1S/C14H14O2S2/c15-18(16,12-14-9-5-2-6-10-14)17-11-13-7-3-1-4-8-13/h1-10H,11-12H2

HIDE SMILES / InChI

Molecular Formula C14H14O2S2
Molecular Weight 278.39
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 12:48:12 GMT 2023
Edited
by admin
on Sat Dec 16 12:48:12 GMT 2023
Record UNII
Q8R7PV32QB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Benzenemethanesulfonothioic acid, S-(phenylmethyl) ester
Systematic Name English
S-(Phenylmethyl) benzenemethanesulfonothioate
Systematic Name English
NSC-74663
Code English
Code System Code Type Description
PUBCHEM
252586
Created by admin on Sat Dec 16 12:48:12 GMT 2023 , Edited by admin on Sat Dec 16 12:48:12 GMT 2023
PRIMARY
EPA CompTox
DTXSID4075112
Created by admin on Sat Dec 16 12:48:12 GMT 2023 , Edited by admin on Sat Dec 16 12:48:12 GMT 2023
PRIMARY
NSC
74663
Created by admin on Sat Dec 16 12:48:12 GMT 2023 , Edited by admin on Sat Dec 16 12:48:12 GMT 2023
PRIMARY
CAS
16601-40-4
Created by admin on Sat Dec 16 12:48:12 GMT 2023 , Edited by admin on Sat Dec 16 12:48:12 GMT 2023
PRIMARY
FDA UNII
Q8R7PV32QB
Created by admin on Sat Dec 16 12:48:12 GMT 2023 , Edited by admin on Sat Dec 16 12:48:12 GMT 2023
PRIMARY