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Details

Stereochemistry ACHIRAL
Molecular Formula C18H24N2S
Molecular Weight 300.462
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of METAPHIT

SMILES

S=C=NC1=CC=CC(=C1)C2(CCCCC2)N3CCCCC3

InChI

InChIKey=FGSGBQAQSPSRJK-UHFFFAOYSA-N
InChI=1S/C18H24N2S/c21-15-19-17-9-7-8-16(14-17)18(10-3-1-4-11-18)20-12-5-2-6-13-20/h7-9,14H,1-6,10-13H2

HIDE SMILES / InChI

Molecular Formula C18H24N2S
Molecular Weight 300.462
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 16:59:49 GMT 2023
Edited
by admin
on Sat Dec 16 16:59:49 GMT 2023
Record UNII
NFS3HJC8WD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METAPHIT
Common Name English
1-(1-(3-ISOTHIOCYANATOPHENYL)CYCLOHEXYL)PIPERIDINE
Systematic Name English
Piperidine, 1-[1-(3-isothiocyanatophenyl)cyclohexyl]-
Systematic Name English
Code System Code Type Description
CAS
96316-00-6
Created by admin on Sat Dec 16 16:59:49 GMT 2023 , Edited by admin on Sat Dec 16 16:59:49 GMT 2023
PRIMARY
EPA CompTox
DTXSID00914572
Created by admin on Sat Dec 16 16:59:49 GMT 2023 , Edited by admin on Sat Dec 16 16:59:49 GMT 2023
PRIMARY
PUBCHEM
114745
Created by admin on Sat Dec 16 16:59:49 GMT 2023 , Edited by admin on Sat Dec 16 16:59:49 GMT 2023
PRIMARY
FDA UNII
NFS3HJC8WD
Created by admin on Sat Dec 16 16:59:49 GMT 2023 , Edited by admin on Sat Dec 16 16:59:49 GMT 2023
PRIMARY
WIKIPEDIA
Metaphit
Created by admin on Sat Dec 16 16:59:49 GMT 2023 , Edited by admin on Sat Dec 16 16:59:49 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT