U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula 2C15H14NS2.Zn
Molecular Weight 610.226
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ZINC DIBENZYLDITHIOCARBAMATE

SMILES

[Zn++].[S-]C(=S)N(CC1=CC=CC=C1)CC2=CC=CC=C2.[S-]C(=S)N(CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChIKey=AUMBZPPBWALQRO-UHFFFAOYSA-L
InChI=1S/2C15H15NS2.Zn/c2*17-15(18)16(11-13-7-3-1-4-8-13)12-14-9-5-2-6-10-14;/h2*1-10H,11-12H2,(H,17,18);/q;;+2/p-2

HIDE SMILES / InChI

Molecular Formula Zn
Molecular Weight 65.409
Charge 2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C15H15NS2
Molecular Weight 273.416
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 Thu Jul 06 02:45:15 UTC 2023
Edited
by admin
on Thu Jul 06 02:45:15 UTC 2023
Record UNII
33RO266515
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ZINC DIBENZYLDITHIOCARBAMATE
Systematic Name English
Code System Code Type Description
SMS_ID
100000159554
Created by admin on Thu Jul 06 02:45:15 UTC 2023 , Edited by admin on Thu Jul 06 02:45:15 UTC 2023
PRIMARY
PUBCHEM
84610
Created by admin on Thu Jul 06 02:45:15 UTC 2023 , Edited by admin on Thu Jul 06 02:45:15 UTC 2023
PRIMARY
EVMPD
SUB169861
Created by admin on Thu Jul 06 02:45:15 UTC 2023 , Edited by admin on Thu Jul 06 02:45:15 UTC 2023
PRIMARY
CAS
14726-36-4
Created by admin on Thu Jul 06 02:45:15 UTC 2023 , Edited by admin on Thu Jul 06 02:45:15 UTC 2023
PRIMARY
EPA CompTox
DTXSID20893254
Created by admin on Thu Jul 06 02:45:15 UTC 2023 , Edited by admin on Thu Jul 06 02:45:15 UTC 2023
PRIMARY
ECHA (EC/EINECS)
238-778-0
Created by admin on Thu Jul 06 02:45:15 UTC 2023 , Edited by admin on Thu Jul 06 02:45:15 UTC 2023
PRIMARY
MESH
C005895
Created by admin on Thu Jul 06 02:45:15 UTC 2023 , Edited by admin on Thu Jul 06 02:45:15 UTC 2023
PRIMARY
FDA UNII
33RO266515
Created by admin on Thu Jul 06 02:45:15 UTC 2023 , Edited by admin on Thu Jul 06 02:45:15 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE