[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl 3-(prop-2-ynylsulfamoyl)benzoate

Systemtic Name: [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl 3-(prop-2-ynylsulfamoyl)benzoate Openeye Name: [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl 3-(prop-2-ynylsulfamoyl)benzoate CAS Name: 3-(prop-2-ynylsulfamoyl)benzoic acid [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl 3-(prop-2-ynylsulfamoyl)benzoate Traditional Name: 3-(propargylsulfamoyl)benzoic acid [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C19H14BrN3O5S MolecularWeight: 476.30056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H14BrN3O5S/c1-2-9-21-29(25,26)16-8-4-6-14(11-16)19(24)27-12-17-22-18(23-28-17)13-5-3-7-15(20)10-13/h1,3-8,10-11,21H,9,12H2