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

Details

Stereochemistry ACHIRAL
Molecular Formula C25H26F3N5O4S
Molecular Weight 549.565
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-methyl-N-(3-morpholin-4-ylpropyl)-5,5-dioxo-1-[3-(trifluoromethyl)phenyl]pyrazolo[4,3-c][1,2]benzothiazine-3-carboxamide

SMILES

CN1C2=C(N(N=C2C(=O)NCCCN3CCOCC3)C4=CC(=CC=C4)C(F)(F)F)C5=CC=CC=C5S1(=O)=O

InChI

InChIKey=FVIHLKNRJXTAQO-UHFFFAOYSA-N
InChI=1S/C25H26F3N5O4S/c1-31-23-21(24(34)29-10-5-11-32-12-14-37-15-13-32)30-33(18-7-4-6-17(16-18)25(26,27)28)22(23)19-8-2-3-9-20(19)38(31,35)36/h2-4,6-9,16H,5,10-15H2,1H3,(H,29,34)

HIDE SMILES / InChI

Approval Year

Name Type Language
4-methyl-N-(3-morpholin-4-ylpropyl)-5,5-dioxo-1-[3-(trifluoromethyl)phenyl]pyrazolo[4,3-c][1,2]benzothiazine-3-carboxamide
Systematic Name English
Pyrazolo[4,3-c][1,2]benzothiazine-3-carboxamide, 1,4-dihydro-4-methyl-N-[3-(4-morpholinyl)propyl]-1-[3-(trifluoromethyl)phenyl]-, 5,5-dioxide
Systematic Name English
4-METHYL-N-(3-(4-MORPHOLINYL)PROPYL)-1-(3-(TRIFLUOROMETHYL)PHENYL)-1,4-DIHYDROPYRAZOLO(4,3-C)(1,2)BENZOTHIAZINE-3-CARBOXAMIDE 5,5-DIOXIDE
Systematic Name English
7-methyl-N-[3-(morpholin-4-yl)propyl]-8,8-dioxo-3-[3-(trifluoromethyl)phenyl]-8lambda6-thia-3,4,7-triazatricyclo[7.4.0.0{2,6}]trideca-1(9),2(6),4,10,12-pentaene-5-carboxamide
Systematic Name English
NSC-373757
Code English
Code System Code Type Description
EPA CompTox
DTXSID60234541
Created by admin on Sat Dec 16 12:56:59 GMT 2023 , Edited by admin on Sat Dec 16 12:56:59 GMT 2023
PRIMARY
NSC
373757
Created by admin on Sat Dec 16 12:56:59 GMT 2023 , Edited by admin on Sat Dec 16 12:56:59 GMT 2023
PRIMARY
PUBCHEM
341477
Created by admin on Sat Dec 16 12:56:59 GMT 2023 , Edited by admin on Sat Dec 16 12:56:59 GMT 2023
PRIMARY
CAS
85364-22-3
Created by admin on Sat Dec 16 12:56:59 GMT 2023 , Edited by admin on Sat Dec 16 12:56:59 GMT 2023
PRIMARY
FDA UNII
M3TUN8XZ58
Created by admin on Sat Dec 16 12:56:59 GMT 2023 , Edited by admin on Sat Dec 16 12:56:59 GMT 2023
PRIMARY