![1-{2-Chloro-6-[(p-chlorophenyl)thio]benzyl}-3-methylurea](/api/spectrum/UYsxAvDciZ/structure.png?h=300&w=458 "1-{2-Chloro-6-[(p-chlorophenyl)thio]benzyl}-3-methylurea")
| SpectraBase Compound ID | TTdv18OCGk |
|---|---|
| InChI | InChI=1S/C15H14Cl2N2OS/c1-18-15(20)19-9-12-13(17)3-2-4-14(12)21-11-7-5-10(16)6-8-11/h2-8H,9H2,1H3,(H2,18,19,20) |
| InChIKey | WKMIVDFNLDHHKC-UHFFFAOYSA-N |
| Mol Weight | 341.26 g/mol |
| Molecular Formula | C15H14Cl2N2OS |
| Exact Mass | 340.02039 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | UYsxAvDciZ |
|---|---|
| Name | 1-{2-Chloro-6-[(p-chlorophenyl)thio]benzyl}-3-methylurea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 340.020389652 u |
| Formula | C15H14Cl2N2OS |
| InChI | InChI=1S/C15H14Cl2N2OS/c1-18-15(20)19-9-12-13(17)3-2-4-14(12)21-11-7-5-10(16)6-8-11/h2-8H,9H2,1H3,(H2,18,19,20) |
| InChIKey | WKMIVDFNLDHHKC-UHFFFAOYSA-N |
| Molecular Weight | 341.256 g/mol |
| SMILES | N(C)C(NCC=1C(=CC=CC1SC=1C=CC(=CC1)Cl)Cl)=O |