methyl 2-[[4-(1-adamantyl)-1,3-thiazol-2-yl]sulfamoyl]benzoate

Systemtic Name: methyl 2-[[4-(1-adamantyl)-1,3-thiazol-2-yl]sulfamoyl]benzoate Openeye Name: methyl 2-[[4-(1-adamantyl)thiazol-2-yl]sulfamoyl]benzoate CAS Name: 2-[[4-(1-adamantyl)-2-thiazolyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[4-(1-adamantyl)-1,3-thiazol-2-yl]sulfamoyl]benzoate Traditional Name: 2-[[4-(1-adamantyl)thiazol-2-yl]sulfamoyl]benzoic acid methyl ester Formula: C21H24N2O4S2 MolecularWeight: 432.55626

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1S(=O)(=O)NC2=NC(=CS2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC(=O)C1=CC=CC=C1S(=O)(=O)NC2=NC(=CS2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H24N2O4S2/c1-27-19(24)16-4-2-3-5-17(16)29(25,26)23-20-22-18(12-28-20)21-9-13-6-14(10-21)8-15(7-13)11-21/h2-5,12-15H,6-11H2,1H3,(H,22,23)