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

Systemtic Name: [5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl 3-(cyclopropylmethylsulfamoyl)benzoate Openeye Name: [5-(p-tolyl)-1,2,4-oxadiazol-3-yl]methyl 3-(cyclopropylmethylsulfamoyl)benzoate CAS Name: 3-(cyclopropylmethylsulfamoyl)benzoic acid [5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl ester IUPAC Name: [5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl 3-(cyclopropylmethylsulfamoyl)benzoate Traditional Name: 3-(cyclopropylmethylsulfamoyl)benzoic acid [5-(p-tolyl)-1,2,4-oxadiazol-3-yl]methyl ester Formula: C21H21N3O5S MolecularWeight: 427.47354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NO2)COC(=O)C3=CC(=CC=C3)S(=O)(=O)NCC4CC4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NO2)COC(=O)C3=CC(=CC=C3)S(=O)(=O)NCC4CC4

InChI

InChI=1S/C21H21N3O5S/c1-14-5-9-16(10-6-14)20-23-19(24-29-20)13-28-21(25)17-3-2-4-18(11-17)30(26,27)22-12-15-7-8-15/h2-6,9-11,15,22H,7-8,12-13H2,1H3