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

Systemtic Name: (3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl 4-methyl-3-[(3-methylphenyl)sulfamoyl]benzoate Openeye Name: (3-isopropyl-1,2,4-oxadiazol-5-yl)methyl 4-methyl-3-(m-tolylsulfamoyl)benzoate CAS Name: 4-methyl-3-[(3-methylphenyl)sulfamoyl]benzoic acid (3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl 4-methyl-3-[(3-methylphenyl)sulfamoyl]benzoate Traditional Name: 4-methyl-3-(m-tolylsulfamoyl)benzoic acid (3-isopropyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=NC(=NO3)C(C)C)C

Isomeric SMILES

CC1=CC(=CC=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=NC(=NO3)C(C)C)C

InChI

InChI=1S/C21H23N3O5S/c1-13(2)20-22-19(29-23-20)12-28-21(25)16-9-8-15(4)18(11-16)30(26,27)24-17-7-5-6-14(3)10-17/h5-11,13,24H,12H2,1-4H3