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

Systemtic Name: (3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 4-chloranyl-3-sulfamoyl-benzoate Openeye Name: [3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl 4-chloro-3-sulfamoyl-benzoate CAS Name: 4-chloro-3-sulfamoylbenzoic acid [3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: (3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 4-chloro-3-sulfamoylbenzoate Traditional Name: 4-chloro-3-sulfamoyl-benzoic acid [3-(3-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=CC(=C(C=C1C(=O)OCC2=NC(=NO2)C3=CSC=C3)S(=O)(=O)N)Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)OCC2=NC(=NO2)C3=CSC=C3)S(=O)(=O)N)Cl

InChI

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