| SpectraBase Spectrum ID |
JpTRfbb3z9E |
| Name |
Methyl 2-{[(3,4-dimethylanilino)carbothioyl]amino}-4,5-dimethyl-3-thiophenecarboxylate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
348.096620238 u |
| Formula |
C17H20N2O2S2 |
| InChI |
InChI=1S/C17H20N2O2S2/c1-9-6-7-13(8-10(9)2)18-17(22)19-15-14(16(20)21-5)11(3)12(4)23-15/h6-8H,1-5H3,(H2,18,19,22) |
| InChIKey |
HWSCRCANKPGTIZ-UHFFFAOYSA-N |
| Molecular Weight |
348.479 g/mol |
| SMILES |
N(C1=C(C(C)=C(S1)C)C(=O)OC)C(NC=1C=C(C)C(=CC1)C)=S |
![Methyl 2-{[(3,4-dimethylanilino)carbothioyl]amino}-4,5-dimethyl-3-thiophenecarboxylate](/api/spectrum/JpTRfbb3z9E/structure.png?h=300&w=458 "Methyl 2-{[(3,4-dimethylanilino)carbothioyl]amino}-4,5-dimethyl-3-thiophenecarboxylate")
