(5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 3-[(phenylmethyl)sulfamoyl]benzoate

Systemtic Name: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 3-[(phenylmethyl)sulfamoyl]benzoate Openeye Name: [5-(3-thienyl)-1,2,4-oxadiazol-3-yl]methyl 3-(benzylsulfamoyl)benzoate CAS Name: 3-[(phenylmethyl)sulfamoyl]benzoic acid [5-(3-thiophenyl)-1,2,4-oxadiazol-3-yl]methyl ester IUPAC Name: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 3-(benzylsulfamoyl)benzoate Traditional Name: 3-(benzylsulfamoyl)benzoic acid [5-(3-thienyl)-1,2,4-oxadiazol-3-yl]methyl ester Formula: C21H17N3O5S2 MolecularWeight: 455.50678

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNS(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=NOC(=N3)C4=CSC=C4

Isomeric SMILES

C1=CC=C(C=C1)CNS(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=NOC(=N3)C4=CSC=C4

InChI

InChI=1S/C21H17N3O5S2/c25-21(28-13-19-23-20(29-24-19)17-9-10-30-14-17)16-7-4-8-18(11-16)31(26,27)22-12-15-5-2-1-3-6-15/h1-11,14,22H,12-13H2