N-[(3,4-dimethoxyphenyl)methyl]-1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-1-(4-fluorophenyl)-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-1-(4-fluorophenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: 1-(4-fluorophenyl)-5-pyrrol-1-yl-N-veratryl-pyrazole-4-carboxamide Formula: C23H21FN4O3 MolecularWeight: 420.436243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)F)N4C=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)F)N4C=CC=C4)OC

InChI

InChI=1S/C23H21FN4O3/c1-30-20-10-5-16(13-21(20)31-2)14-25-22(29)19-15-26-28(18-8-6-17(24)7-9-18)23(19)27-11-3-4-12-27/h3-13,15H,14H2,1-2H3,(H,25,29)