[2-[(3-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] 4-(1,3,4-oxadiazol-2-yl)benzoate

Systemtic Name: [2-[(3-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] 4-(1,3,4-oxadiazol-2-yl)benzoate Openeye Name: [2-(3-methylsulfonylanilino)-2-oxo-ethyl] 4-(1,3,4-oxadiazol-2-yl)benzoate CAS Name: 4-(1,3,4-oxadiazol-2-yl)benzoic acid [2-(3-methylsulfonylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylsulfonylanilino)-2-oxoethyl] 4-(1,3,4-oxadiazol-2-yl)benzoate Traditional Name: 4-(1,3,4-oxadiazol-2-yl)benzoic acid [2-keto-2-(3-mesylanilino)ethyl] ester Formula: C18H15N3O6S MolecularWeight: 401.3932

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)NC(=O)COC(=O)C2=CC=C(C=C2)C3=NN=CO3

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)NC(=O)COC(=O)C2=CC=C(C=C2)C3=NN=CO3

InChI

InChI=1S/C18H15N3O6S/c1-28(24,25)15-4-2-3-14(9-15)20-16(22)10-26-18(23)13-7-5-12(6-8-13)17-21-19-11-27-17/h2-9,11H,10H2,1H3,(H,20,22)