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

Details

Stereochemistry MIXED
Molecular Formula C19H28N4S
Molecular Weight 344.517
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-[[4-(1,2-Benzisothiazol-3-yl)-1-piperazinyl]methyl]cyclohexanemethanamine

SMILES

NCC1CCCCC1CN2CCN(CC2)C3=NSC4=C3C=CC=C4

InChI

InChIKey=ISNHCWHFMIPSEZ-UHFFFAOYSA-N
InChI=1S/C19H28N4S/c20-13-15-5-1-2-6-16(15)14-22-9-11-23(12-10-22)19-17-7-3-4-8-18(17)24-21-19/h3-4,7-8,15-16H,1-2,5-6,9-14,20H2

HIDE SMILES / InChI

Approval Year

Name Type Language
1-(2-{[4-(1,2-Benzothiazol-3-yl)piperazin-1-yl]methyl}cyclohexyl)methanamine
Preferred Name English
2-[[4-(1,2-Benzisothiazol-3-yl)-1-piperazinyl]methyl]cyclohexanemethanamine
Systematic Name English
Cyclohexanemethanamine, 2-[[4-(1,2-benzisothiazol-3-yl)-1-piperazinyl]methyl]-
Systematic Name English
Code System Code Type Description
PUBCHEM
76666629
Created by admin on Wed Apr 02 20:51:57 GMT 2025 , Edited by admin on Wed Apr 02 20:51:57 GMT 2025
PRIMARY
CAS
1644295-06-6
Created by admin on Wed Apr 02 20:51:57 GMT 2025 , Edited by admin on Wed Apr 02 20:51:57 GMT 2025
PRIMARY
FDA UNII
2CR5KH5EQK
Created by admin on Wed Apr 02 20:51:57 GMT 2025 , Edited by admin on Wed Apr 02 20:51:57 GMT 2025
PRIMARY