(4-pyrazol-1-ylphenyl)methyl 3-(diethylsulfamoyl)-4-methyl-benzoate

Systemtic Name: (4-pyrazol-1-ylphenyl)methyl 3-(diethylsulfamoyl)-4-methyl-benzoate Openeye Name: (4-pyrazol-1-ylphenyl)methyl 3-(diethylsulfamoyl)-4-methyl-benzoate CAS Name: 3-(diethylsulfamoyl)-4-methylbenzoic acid [4-(1-pyrazolyl)phenyl]methyl ester IUPAC Name: (4-pyrazol-1-ylphenyl)methyl 3-(diethylsulfamoyl)-4-methylbenzoate Traditional Name: 3-(diethylsulfamoyl)-4-methyl-benzoic acid (4-pyrazol-1-ylbenzyl) ester Formula: C22H25N3O4S MolecularWeight: 427.5166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OCC2=CC=C(C=C2)N3C=CC=N3)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OCC2=CC=C(C=C2)N3C=CC=N3)C

InChI

InChI=1S/C22H25N3O4S/c1-4-24(5-2)30(27,28)21-15-19(10-7-17(21)3)22(26)29-16-18-8-11-20(12-9-18)25-14-6-13-23-25/h6-15H,4-5,16H2,1-3H3