ethyl 1-[3-(phenylsulfonylamino)phenyl]-5-(trifluoromethyl)pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[3-(phenylsulfonylamino)phenyl]-5-(trifluoromethyl)pyrazole-4-carboxylate Openeye Name: ethyl 1-[3-(benzenesulfonamido)phenyl]-5-(trifluoromethyl)pyrazole-4-carboxylate CAS Name: 1-[3-(benzenesulfonamido)phenyl]-5-(trifluoromethyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(benzenesulfonamido)phenyl]-5-(trifluoromethyl)pyrazole-4-carboxylate Traditional Name: 1-[3-(benzenesulfonamido)phenyl]-5-(trifluoromethyl)pyrazole-4-carboxylic acid ethyl ester Formula: C19H16F3N3O4S MolecularWeight: 439.40825

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C19H16F3N3O4S/c1-2-29-18(26)16-12-23-25(17(16)19(20,21)22)14-8-6-7-13(11-14)24-30(27,28)15-9-4-3-5-10-15/h3-12,24H,2H2,1H3