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

Systemtic Name: 1-[(3,5-dimethylphenoxy)methyl]-N-(5-ethylsulfonyl-2-oxidanyl-phenyl)pyrazole-3-carboxamide Openeye Name: 1-[(3,5-dimethylphenoxy)methyl]-N-(5-ethylsulfonyl-2-hydroxy-phenyl)pyrazole-3-carboxamide CAS Name: 1-[(3,5-dimethylphenoxy)methyl]-N-(5-ethylsulfonyl-2-hydroxyphenyl)-3-pyrazolecarboxamide IUPAC Name: 1-[(3,5-dimethylphenoxy)methyl]-N-(5-ethylsulfonyl-2-hydroxyphenyl)pyrazole-3-carboxamide Traditional Name: 1-[(3,5-dimethylphenoxy)methyl]-N-(5-esyl-2-hydroxy-phenyl)pyrazole-3-carboxamide Formula: C21H23N3O5S MolecularWeight: 429.48942

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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(=C3)C)C

Isomeric SMILES

CCS(=O)(=O)C1=CC(=C(C=C1)O)NC(=O)C2=NN(C=C2)COC3=CC(=CC(=C3)C)C

InChI

InChI=1S/C21H23N3O5S/c1-4-30(27,28)17-5-6-20(25)19(12-17)22-21(26)18-7-8-24(23-18)13-29-16-10-14(2)9-15(3)11-16/h5-12,25H,4,13H2,1-3H3,(H,22,26)