(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 4-chloranyl-3-sulfamoyl-benzoate

Systemtic Name: (3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 4-chloranyl-3-sulfamoyl-benzoate Openeye Name: [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl 4-chloro-3-sulfamoyl-benzoate CAS Name: 4-chloro-3-sulfamoylbenzoic acid (3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 4-chloro-3-sulfamoylbenzoate Traditional Name: 4-chloro-3-sulfamoyl-benzoic acid [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C14H10ClN3O5S2 MolecularWeight: 399.8293

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NOC(=N2)COC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N

Isomeric SMILES

C1=CSC(=C1)C2=NOC(=N2)COC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N

InChI

InChI=1S/C14H10ClN3O5S2/c15-9-4-3-8(6-11(9)25(16,20)21)14(19)22-7-12-17-13(18-23-12)10-2-1-5-24-10/h1-6H,7H2,(H2,16,20,21)