(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 4-(prop-2-ynylsulfamoyl)benzoate

Systemtic Name: (3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 4-(prop-2-ynylsulfamoyl)benzoate Openeye Name: [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl 4-(prop-2-ynylsulfamoyl)benzoate CAS Name: 4-(prop-2-ynylsulfamoyl)benzoic 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-(prop-2-ynylsulfamoyl)benzoate Traditional Name: 4-(propargylsulfamoyl)benzoic acid [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C17H13N3O5S2 MolecularWeight: 403.43222

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC2=NC(=NO2)C3=CC=CS3

Isomeric SMILES

C#CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC2=NC(=NO2)C3=CC=CS3

InChI

InChI=1S/C17H13N3O5S2/c1-2-9-18-27(22,23)13-7-5-12(6-8-13)17(21)24-11-15-19-16(20-25-15)14-4-3-10-26-14/h1,3-8,10,18H,9,11H2