N-(5-ethylsulfonyl-2-oxidanyl-phenyl)-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(5-ethylsulfonyl-2-oxidanyl-phenyl)-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-(5-ethylsulfonyl-2-hydroxy-phenyl)-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-(5-ethylsulfonyl-2-hydroxyphenyl)-1-[(2-methylphenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(5-ethylsulfonyl-2-hydroxyphenyl)-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-(5-esyl-2-hydroxy-phenyl)-1-[(2-methylphenoxy)methyl]pyrazole-3-carboxamide Formula: C20H21N3O5S MolecularWeight: 415.46284

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC(=C(C=C1)O)NC(=O)C2=NN(C=C2)COC3=CC=CC=C3C

Isomeric SMILES

CCS(=O)(=O)C1=CC(=C(C=C1)O)NC(=O)C2=NN(C=C2)COC3=CC=CC=C3C

InChI

InChI=1S/C20H21N3O5S/c1-3-29(26,27)15-8-9-18(24)17(12-15)21-20(25)16-10-11-23(22-16)13-28-19-7-5-4-6-14(19)2/h4-12,24H,3,13H2,1-2H3,(H,21,25)