![4-{[(4-chloroanilino)carbonyl]amino}benzenesulfonamide](/api/spectrum/BVYtQD1nfsc/structure.png?h=300&w=458 "4-{[(4-chloroanilino)carbonyl]amino}benzenesulfonamide")
| SpectraBase Compound ID | 3pDatNwpgah |
|---|---|
| InChI | InChI=1S/C13H12ClN3O3S/c14-9-1-3-10(4-2-9)16-13(18)17-11-5-7-12(8-6-11)21(15,19)20/h1-8H,(H2,15,19,20)(H2,16,17,18) |
| InChIKey | HACQCGHVZICZSC-UHFFFAOYSA-N |
| Mol Weight | 325.77 g/mol |
| Molecular Formula | C13H12ClN3O3S |
| Exact Mass | 325.02879 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BVYtQD1nfsc |
|---|---|
| Name | 4-{[(4-chloroanilino)carbonyl]amino}benzenesulfonamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 325.028790129 u |
| Formula | C13H12ClN3O3S |
| InChI | InChI=1S/C13H12ClN3O3S/c14-9-1-3-10(4-2-9)16-13(18)17-11-5-7-12(8-6-11)21(15,19)20/h1-8H,(H2,15,19,20)(H2,16,17,18) |
| InChIKey | HACQCGHVZICZSC-UHFFFAOYSA-N |
| SMILES | N(C(NC1=CC=C(S(=O)(=O)N)C=C1)=O)C1=CC=C(C=C1)Cl |