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Details

Stereochemistry ACHIRAL
Molecular Formula C14H20N4OS
Molecular Weight 292.4
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of Hexahydro-1H-azepine-1-carbothioic acid 2-[1-(1-oxido-2-pyridinyl)ethylidene]hydrazide

SMILES

C\C(=N/NC(=S)N1CCCCCC1)C2=[N+]([O-])C=CC=C2

InChI

InChIKey=QHUHDNIUDOEKGY-NTCAYCPXSA-N
InChI=1S/C14H20N4OS/c1-12(13-8-4-7-11-18(13)19)15-16-14(20)17-9-5-2-3-6-10-17/h4,7-8,11H,2-3,5-6,9-10H2,1H3,(H,16,20)/b15-12+

HIDE SMILES / InChI

Molecular Formula C14H20N4OS
Molecular Weight 292.4
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:41:07 GMT 2023
Edited
by admin
on Sat Dec 16 12:41:07 GMT 2023
Record UNII
U7B5QVY7PW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Hexahydro-1H-azepine-1-carbothioic acid 2-[1-(1-oxido-2-pyridinyl)ethylidene]hydrazide
Systematic Name English
1H-Azepine-1-carbothioic acid, hexahydro-, [1-(1-oxido-2-pyridinyl)ethylidene]hydrazide
Systematic Name English
NSC-351075
Common Name English
1H-Azepine-1-carbothioic acid, hexahydro-, 2-[1-(1-oxido-2-pyridinyl)ethylidene]hydrazide
Systematic Name English
Code System Code Type Description
FDA UNII
U7B5QVY7PW
Created by admin on Sat Dec 16 12:41:07 GMT 2023 , Edited by admin on Sat Dec 16 12:41:07 GMT 2023
PRIMARY
EPA CompTox
DTXSID101007670
Created by admin on Sat Dec 16 12:41:07 GMT 2023 , Edited by admin on Sat Dec 16 12:41:07 GMT 2023
PRIMARY
CAS
87587-04-0
Created by admin on Sat Dec 16 12:41:07 GMT 2023 , Edited by admin on Sat Dec 16 12:41:07 GMT 2023
PRIMARY
NSC
351075
Created by admin on Sat Dec 16 12:41:07 GMT 2023 , Edited by admin on Sat Dec 16 12:41:07 GMT 2023
PRIMARY