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Details

Stereochemistry RACEMIC
Molecular Formula C12H19N3OS
Molecular Weight 253.364
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-TERT-BUTYL-3-ISOPROPYL-4,5,6,7-TETRAHYDROISOTHIAZOLO(5,4-D)PYRIMIDIN-4-ONE

SMILES

CC(C)C1=NSC2=C1C(=O)NC(N2)C(C)(C)C

InChI

InChIKey=VIRHBOCOABUCDD-UHFFFAOYSA-N
InChI=1S/C12H19N3OS/c1-6(2)8-7-9(16)13-11(12(3,4)5)14-10(7)17-15-8/h6,11,14H,1-5H3,(H,13,16)

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
NSC-287101
Preferred Name English
6-TERT-BUTYL-3-ISOPROPYL-4,5,6,7-TETRAHYDROISOTHIAZOLO(5,4-D)PYRIMIDIN-4-ONE
Systematic Name English
ISOTHIAZOLO(5,4-D)PYRIMIDIN-4(5H)-ONE, 6-(1,1-DIMETHYLETHYL)-6,7-DIHYDRO-3-(1-METHYLETHYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
F243464K8U
Created by admin on Tue Apr 01 19:56:02 GMT 2025 , Edited by admin on Tue Apr 01 19:56:02 GMT 2025
PRIMARY
CAS
58045-26-4
Created by admin on Tue Apr 01 19:56:02 GMT 2025 , Edited by admin on Tue Apr 01 19:56:02 GMT 2025
PRIMARY
NSC
287101
Created by admin on Tue Apr 01 19:56:02 GMT 2025 , Edited by admin on Tue Apr 01 19:56:02 GMT 2025
PRIMARY
PUBCHEM
323919
Created by admin on Tue Apr 01 19:56:02 GMT 2025 , Edited by admin on Tue Apr 01 19:56:02 GMT 2025
PRIMARY
NIH
NCATS
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