| SpectraBase Spectrum ID |
JcixjijalGS |
| Name |
3'-Chloro-4-methyl-4,5,6,7-tetrahydrothiothieno[3,2-C]pyridine-5-carboxy-p-toluidide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
336.052168603 u |
| Formula |
C16H17ClN2S2 |
| InChI |
InChI=1S/C16H17ClN2S2/c1-10-3-4-12(9-14(10)17)18-16(20)19-7-5-15-13(11(19)2)6-8-21-15/h3-4,6,8-9,11H,5,7H2,1-2H3,(H,18,20) |
| InChIKey |
PGICNRVXSNMSTO-UHFFFAOYSA-N |
| Molecular Weight |
336.899 g/mol |
| SMILES |
N(C1=CC=C(C(=C1)Cl)C)C(N1CCC=2SC=CC2C1C)=S |
![3'-Chloro-4-methyl-4,5,6,7-tetrahydrothiothieno[3,2-C]pyridine-5-carboxy-p-toluidide](/api/spectrum/JcixjijalGS/structure.png?h=300&w=458 "3'-Chloro-4-methyl-4,5,6,7-tetrahydrothiothieno[3,2-C]pyridine-5-carboxy-p-toluidide")
