AC1O3YEL
4-[[(E)-N-(4-chlorophenyl)sulfonyl-C-phenylcarbonimidoyl]carbamothioylamino]benzoic acid
Also Known As: CBMicro_008975|BIM-0008989.P001|4-[[(E)-N-(4-chlorophenyl)sulfonyl-C-phenylcarbonimidoyl]carbamothioylamino]benzoic acid|4-[({[{[(4-chlorophenyl)sulfonyl]imino}(phenyl)methyl]amino}carbonothioyl)amino]benzoic acid
CAS: 202056-56-2
| Molecular Formula | C21H16ClN3O4S2 |
|---|---|
| Molecular Weight | 473.02707 g/mol |
| LogP | 4.1603 |
| Topological Polar Surface Area | 107.86 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 473.02707 |
| Monoisotopic Mass | 473.02707 |
| Heavy Atoms | 31 |
| Complexity | 1227.8812 |
Chemical Identifiers
| CAS Number | 202056-56-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C(=N\S(=O)(=O)C2=CC=C(C=C2)Cl)/NC(=S)NC3=CC=C(C=C3)C(=O)O |
Product Overview
AC1O3YEL (CAS 202056-56-2), with molecular formula C21H16ClN3O4S2 and molecular weight 473.02707 g/mol. IUPAC: 4-[[(E)-N-(4-chlorophenyl)sulfonyl-C-phenylcarbonimidoyl]carbamothioylamino]benzoic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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