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

Systemtic Name: N-[(4-butoxy-3-methoxy-phenyl)methyl]-5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide Openeye Name: N-[(4-butoxy-3-methoxy-phenyl)methyl]-5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide CAS Name: N-[(4-butoxy-3-methoxyphenyl)methyl]-5-chloro-1-(4-fluorophenyl)-3-methyl-4-pyrazolecarboxamide IUPAC Name: N-[(4-butoxy-3-methoxyphenyl)methyl]-5-chloro-1-(4-fluorophenyl)-3-methylpyrazole-4-carboxamide Traditional Name: N-(4-butoxy-3-methoxy-benzyl)-5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide Formula: C23H25ClFN3O3 MolecularWeight: 445.914303

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CNC(=O)C2=C(N(N=C2C)C3=CC=C(C=C3)F)Cl)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CNC(=O)C2=C(N(N=C2C)C3=CC=C(C=C3)F)Cl)OC

InChI

InChI=1S/C23H25ClFN3O3/c1-4-5-12-31-19-11-6-16(13-20(19)30-3)14-26-23(29)21-15(2)27-28(22(21)24)18-9-7-17(25)8-10-18/h6-11,13H,4-5,12,14H2,1-3H3,(H,26,29)