ethyl 5-[(4-methylphenyl)methylsulfamoyl]-1H-pyrazole-3-carboxylate

Systemtic Name: ethyl 5-[(4-methylphenyl)methylsulfamoyl]-1H-pyrazole-3-carboxylate Openeye Name: ethyl 5-(p-tolylmethylsulfamoyl)-1H-pyrazole-3-carboxylate CAS Name: 5-[(4-methylphenyl)methylsulfamoyl]-1H-pyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-methylphenyl)methylsulfamoyl]-1H-pyrazole-3-carboxylate Traditional Name: 5-[(4-methylbenzyl)sulfamoyl]-1H-pyrazole-3-carboxylic acid ethyl ester Formula: C14H17N3O4S MolecularWeight: 323.36748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NNC(=C1)S(=O)(=O)NCC2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C1=NNC(=C1)S(=O)(=O)NCC2=CC=C(C=C2)C

InChI

InChI=1S/C14H17N3O4S/c1-3-21-14(18)12-8-13(17-16-12)22(19,20)15-9-11-6-4-10(2)5-7-11/h4-8,15H,3,9H2,1-2H3,(H,16,17)