methyl 4-[[[3-(phenylsulfonylmethyl)-1,2,4-oxadiazol-5-yl]carbonylamino]methyl]benzoate

Systemtic Name: methyl 4-[[[3-(phenylsulfonylmethyl)-1,2,4-oxadiazol-5-yl]carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[[3-(benzenesulfonylmethyl)-1,2,4-oxadiazole-5-carbonyl]amino]methyl]benzoate CAS Name: 4-[[[[3-(benzenesulfonylmethyl)-1,2,4-oxadiazol-5-yl]-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[3-(benzenesulfonylmethyl)-1,2,4-oxadiazole-5-carbonyl]amino]methyl]benzoate Traditional Name: 4-[[[3-(besylmethyl)-1,2,4-oxadiazole-5-carbonyl]amino]methyl]benzoic acid methyl ester Formula: C19H17N3O6S MolecularWeight: 415.41978

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=NC(=NO2)CS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=NC(=NO2)CS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H17N3O6S/c1-27-19(24)14-9-7-13(8-10-14)11-20-17(23)18-21-16(22-28-18)12-29(25,26)15-5-3-2-4-6-15/h2-10H,11-12H2,1H3,(H,20,23)