ethyl 5-[[4-(2-methylbutan-2-yl)phenyl]sulfonylamino]-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[[4-(2-methylbutan-2-yl)phenyl]sulfonylamino]-1H-pyrazole-4-carboxylate Openeye Name: ethyl 5-[[4-(1,1-dimethylpropyl)phenyl]sulfonylamino]-1H-pyrazole-4-carboxylate CAS Name: 5-[[4-(2-methylbutan-2-yl)phenyl]sulfonylamino]-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[[4-(2-methylbutan-2-yl)phenyl]sulfonylamino]-1H-pyrazole-4-carboxylate Traditional Name: 5-[(4-tert-amylphenyl)sulfonylamino]-1H-pyrazole-4-carboxylic acid ethyl ester Formula: C17H23N3O4S MolecularWeight: 365.44722

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C=NN2)C(=O)OCC

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C=NN2)C(=O)OCC

InChI

InChI=1S/C17H23N3O4S/c1-5-17(3,4)12-7-9-13(10-8-12)25(22,23)20-15-14(11-18-19-15)16(21)24-6-2/h7-11H,5-6H2,1-4H3,(H2,18,19,20)