methyl 4-[[5-(4-propan-2-ylsulfonylphenyl)-1,3,4-oxadiazol-2-yl]carbamoyl]benzoate

Systemtic Name: methyl 4-[[5-(4-propan-2-ylsulfonylphenyl)-1,3,4-oxadiazol-2-yl]carbamoyl]benzoate Openeye Name: methyl 4-[[5-(4-isopropylsulfonylphenyl)-1,3,4-oxadiazol-2-yl]carbamoyl]benzoate CAS Name: 4-[oxo-[[5-(4-propan-2-ylsulfonylphenyl)-1,3,4-oxadiazol-2-yl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[5-(4-propan-2-ylsulfonylphenyl)-1,3,4-oxadiazol-2-yl]carbamoyl]benzoate Traditional Name: 4-[[5-(4-isopropylsulfonylphenyl)-1,3,4-oxadiazol-2-yl]carbamoyl]benzoic acid methyl ester Formula: C20H19N3O6S MolecularWeight: 429.44636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CC=C(C=C1)C2=NN=C(O2)NC(=O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC(C)S(=O)(=O)C1=CC=C(C=C1)C2=NN=C(O2)NC(=O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H19N3O6S/c1-12(2)30(26,27)16-10-8-14(9-11-16)18-22-23-20(29-18)21-17(24)13-4-6-15(7-5-13)19(25)28-3/h4-12H,1-3H3,(H,21,23,24)