| SpectraBase Spectrum ID |
45NIyjL80qF |
| Name |
2-({2-[(4,6-Dimethyl-2-pyrimidinyl)sulfanyl]ethyl}sulfonyl)-1,3-benzothiazole |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
365.032640255 u |
| Formula |
C15H15N3O2S3 |
| InChI |
InChI=1S/C15H15N3O2S3/c1-10-9-11(2)17-14(16-10)21-7-8-23(19,20)15-18-12-5-3-4-6-13(12)22-15/h3-6,9H,7-8H2,1-2H3 |
| InChIKey |
CKRRUAXDGXHDRW-UHFFFAOYSA-N |
| Molecular Weight |
365.484 g/mol |
| SMILES |
C1(S(CCSC2=NC(C)=CC(=N2)C)(=O)=O)=NC=2C=CC=CC2S1 |
![2-({2-[(4,6-Dimethyl-2-pyrimidinyl)sulfanyl]ethyl}sulfonyl)-1,3-benzothiazole](/api/spectrum/45NIyjL80qF/structure.png?h=300&w=458 "2-({2-[(4,6-Dimethyl-2-pyrimidinyl)sulfanyl]ethyl}sulfonyl)-1,3-benzothiazole")
