Drug Information
| Drug General Information | Top | |||
|---|---|---|---|---|
| Drug ID |
D0U1AN
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| Former ID |
DNC005245
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| Drug Name |
4-isothiocyanatobenzenesulfonamide
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| Synonyms |
4-Isothiocyanatobenzenesulfonamide; 51908-29-3; 4-isothiocyanatobenzene-1-sulfonamide; 4-Isothiocyanato-benzenesulfonamide; Benzenesulfonamide, 4-isothiocyanato-; CHEMBL144818; IMDUFDNFSJWYQT-UHFFFAOYSA-N; 4-Isothiocyanatobenzene sulfonamide; 4-Icsa; AC1LAVHK; SCHEMBL1476527; CTK4J5100; DTXSID90199871; MolPort-000-156-692; KS-00000HK9; ZINC2571868; ALBB-003064; 4-(Isothiocyanato)benzenesulfonamide; Benzenesulfonamide,4-isothiocyanato-; GEO-03379; BDBM50094812; ANW-51072; STK501629; 4-(aminosulfonyl)phenylisothiocyanate; SBB046978
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
| Structure |
 |
Download2D MOL |
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| Formula |
C7H6N2O2S2
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| Canonical SMILES |
C1=CC(=CC=C1N=C=S)S(=O)(=O)N
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| InChI |
1S/C7H6N2O2S2/c8-13(10,11)7-3-1-6(2-4-7)9-5-12/h1-4H,(H2,8,10,11)
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| InChIKey |
IMDUFDNFSJWYQT-UHFFFAOYSA-N
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| CAS Number |
CAS 51908-29-3
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| PubChem Compound ID | ||||
| Target and Pathway | Top | |||
|---|---|---|---|---|
| Target(s) | Carbonic anhydrase I (CA-I) | Target Info | Inhibitor | [1] |
| Carbonic anhydrase II (CA-II) | Target Info | Inhibitor | [1] | |
| KEGG Pathway | Nitrogen metabolism | |||
| Proximal tubule bicarbonate reclamation | ||||
| Collecting duct acid secretion | ||||
| Gastric acid secretion | ||||
| Pancreatic secretion | ||||
| Bile secretion | ||||
| NetPath Pathway | IL4 Signaling Pathway | |||
| EGFR1 Signaling Pathway | ||||
| Pathwhiz Pathway | Gastric Acid Production | |||
| Pathway Interaction Database | C-MYB transcription factor network | |||
| Reactome | Erythrocytes take up carbon dioxide and release oxygen | |||
| Erythrocytes take up oxygen and release carbon dioxide | ||||
| Reversible hydration of carbon dioxide | ||||
| WikiPathways | Reversible Hydration of Carbon Dioxide | |||
| Uptake of Carbon Dioxide and Release of Oxygen by Erythrocytes | ||||
| Uptake of Oxygen and Release of Carbon Dioxide by Erythrocytes | ||||
| References | Top | |||
|---|---|---|---|---|
| REF 1 | Carbonic anhydrase inhibitors: the first on-resin screening of a 4-sulfamoylphenylthiourea library. J Med Chem. 2004 Oct 7;47(21):5224-9. | |||
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