![5-chloro-3-methylbenzo[b]thien-2-yl {{5-[(cyclopropylmethyl)thio]-1,3,4-thiadiazol-2-yl}thio}methyl ketone](/api/spectrum/CmdF3NPc6Mf/structure.png?h=300&w=458 "5-chloro-3-methylbenzo[b]thien-2-yl {{5-[(cyclopropylmethyl)thio]-1,3,4-thiadiazol-2-yl}thio}methyl ketone")
| SpectraBase Compound ID | 7s9553pte7V |
|---|---|
| InChI | InChI=1S/C17H15ClN2OS4/c1-9-12-6-11(18)4-5-14(12)24-15(9)13(21)8-23-17-20-19-16(25-17)22-7-10-2-3-10/h4-6,10H,2-3,7-8H2,1H3 |
| InChIKey | KACUDUPWUCIJOA-UHFFFAOYSA-N |
| Mol Weight | 427.0 g/mol |
| Molecular Formula | C17H15ClN2OS4 |
| Exact Mass | 425.975576 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CmdF3NPc6Mf |
|---|---|
| Name | 5-chloro-3-methylbenzo[b]thien-2-yl {{5-[(cyclopropylmethyl)thio]-1,3,4-thiadiazol-2-yl}thio}methyl ketone |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H15ClN2OS4 |
| InChI | InChI=1S/C17H15ClN2OS4/c1-9-12-6-11(18)4-5-14(12)24-15(9)13(21)8-23-17-20-19-16(25-17)22-7-10-2-3-10/h4-6,10H,2-3,7-8H2,1H3 |
| InChIKey | KACUDUPWUCIJOA-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 59051M |
| Solvent | CDCl3 |