5-chloranyl-N-[[2-(ethoxymethyl)phenyl]methyl]-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-N-[[2-(ethoxymethyl)phenyl]methyl]-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide Openeye Name: 5-chloro-N-[[2-(ethoxymethyl)phenyl]methyl]-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide CAS Name: 5-chloro-N-[[2-(ethoxymethyl)phenyl]methyl]-1-(4-fluorophenyl)-3-methyl-4-pyrazolecarboxamide IUPAC Name: 5-chloro-N-[[2-(ethoxymethyl)phenyl]methyl]-1-(4-fluorophenyl)-3-methylpyrazole-4-carboxamide Traditional Name: 5-chloro-N-[2-(ethoxymethyl)benzyl]-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide Formula: C21H21ClFN3O2 MolecularWeight: 401.861743

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=CC=CC=C1CNC(=O)C2=C(N(N=C2C)C3=CC=C(C=C3)F)Cl

Isomeric SMILES

CCOCC1=CC=CC=C1CNC(=O)C2=C(N(N=C2C)C3=CC=C(C=C3)F)Cl

InChI

InChI=1S/C21H21ClFN3O2/c1-3-28-13-16-7-5-4-6-15(16)12-24-21(27)19-14(2)25-26(20(19)22)18-10-8-17(23)9-11-18/h4-11H,3,12-13H2,1-2H3,(H,24,27)