ethyl 5-[[4-[2-(tert-butylsulfamoyl)phenyl]phenyl]methyl]-3-cyclopropyl-1-ethyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[[4-[2-(tert-butylsulfamoyl)phenyl]phenyl]methyl]-3-cyclopropyl-1-ethyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[[4-[2-(tert-butylsulfamoyl)phenyl]phenyl]methyl]-3-cyclopropyl-1-ethyl-pyrazole-4-carboxylate CAS Name: 5-[[4-[2-(tert-butylsulfamoyl)phenyl]phenyl]methyl]-3-cyclopropyl-1-ethyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[4-[2-(tert-butylsulfamoyl)phenyl]phenyl]methyl]-3-cyclopropyl-1-ethylpyrazole-4-carboxylate Traditional Name: 5-[4-[2-(tert-butylsulfamoyl)phenyl]benzyl]-3-cyclopropyl-1-ethyl-pyrazole-4-carboxylic acid ethyl ester Formula: C28H35N3O4S MolecularWeight: 509.6602

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C2CC2)C(=O)OCC)CC3=CC=C(C=C3)C4=CC=CC=C4S(=O)(=O)NC(C)(C)C

Isomeric SMILES

CCN1C(=C(C(=N1)C2CC2)C(=O)OCC)CC3=CC=C(C=C3)C4=CC=CC=C4S(=O)(=O)NC(C)(C)C

InChI

InChI=1S/C28H35N3O4S/c1-6-31-23(25(27(32)35-7-2)26(29-31)21-16-17-21)18-19-12-14-20(15-13-19)22-10-8-9-11-24(22)36(33,34)30-28(3,4)5/h8-15,21,30H,6-7,16-18H2,1-5H3