(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl 4-(dimethylsulfamoyl)benzoate

Systemtic Name: (3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl 4-(dimethylsulfamoyl)benzoate Openeye Name: (3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl 4-(dimethylsulfamoyl)benzoate CAS Name: 4-(dimethylsulfamoyl)benzoic acid (3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl ester IUPAC Name: (3,5-dimethyl-1-phenylpyrazol-4-yl)methyl 4-(dimethylsulfamoyl)benzoate Traditional Name: 4-(dimethylsulfamoyl)benzoic acid (3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl ester Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)COC(=O)C3=CC=C(C=C3)S(=O)(=O)N(C)C

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)COC(=O)C3=CC=C(C=C3)S(=O)(=O)N(C)C

InChI

InChI=1S/C21H23N3O4S/c1-15-20(16(2)24(22-15)18-8-6-5-7-9-18)14-28-21(25)17-10-12-19(13-11-17)29(26,27)23(3)4/h5-13H,14H2,1-4H3