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

Details

Stereochemistry ACHIRAL
Molecular Formula C6H11NS2.C5H11N
Molecular Weight 246.436
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PIPERIDINIUM PENTAMETHYLENEDITHIOCARBAMATE

SMILES

C1CCNCC1.SC(=S)N2CCCCC2

InChI

InChIKey=PVFZKRMYBKEXBN-UHFFFAOYSA-N
InChI=1S/C6H11NS2.C5H11N/c8-6(9)7-4-2-1-3-5-7;1-2-4-6-5-3-1/h1-5H2,(H,8,9);6H,1-5H2

HIDE SMILES / InChI

Molecular Formula C6H11NS2
Molecular Weight 161.288
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C5H11N
Molecular Weight 85.1475
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 Fri Dec 15 17:46:04 GMT 2023
Edited
by admin
on Fri Dec 15 17:46:04 GMT 2023
Record UNII
7K715ND7EP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PIPERIDINIUM PENTAMETHYLENEDITHIOCARBAMATE
Common Name English
PIPERIDINE PENTAMETHYLENE DITHIOCARBAMATE
Common Name English
PIPERIDINE-1-CARBODITHIOIC ACID - PIPERIDINE (1:1)
Systematic Name English
NSC-1906
Code English
NSC-4712
Code English
Code System Code Type Description
NSC
1906
Created by admin on Fri Dec 15 17:46:04 GMT 2023 , Edited by admin on Fri Dec 15 17:46:04 GMT 2023
PRIMARY
FDA UNII
7K715ND7EP
Created by admin on Fri Dec 15 17:46:04 GMT 2023 , Edited by admin on Fri Dec 15 17:46:04 GMT 2023
PRIMARY
CAS
98-77-1
Created by admin on Fri Dec 15 17:46:04 GMT 2023 , Edited by admin on Fri Dec 15 17:46:04 GMT 2023
PRIMARY
ECHA (EC/EINECS)
202-698-4
Created by admin on Fri Dec 15 17:46:04 GMT 2023 , Edited by admin on Fri Dec 15 17:46:04 GMT 2023
PRIMARY
EPA CompTox
DTXSID90883288
Created by admin on Fri Dec 15 17:46:04 GMT 2023 , Edited by admin on Fri Dec 15 17:46:04 GMT 2023
PRIMARY
PUBCHEM
72508
Created by admin on Fri Dec 15 17:46:04 GMT 2023 , Edited by admin on Fri Dec 15 17:46:04 GMT 2023
PRIMARY
NSC
4712
Created by admin on Fri Dec 15 17:46:04 GMT 2023 , Edited by admin on Fri Dec 15 17:46:04 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE