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

Systemtic Name: N-(3,4-dimethoxyphenyl)-1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-(3,4-dimethoxyphenyl)-1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: N-(3,4-dimethoxyphenyl)-1-(4-fluorophenyl)-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-(3,4-dimethoxyphenyl)-1-(4-fluorophenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-(3,4-dimethoxyphenyl)-1-(4-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C22H19FN4O3 MolecularWeight: 406.409663

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19FN4O3/c1-29-19-10-7-16(13-20(19)30-2)25-21(28)18-14-24-27(17-8-5-15(23)6-9-17)22(18)26-11-3-4-12-26/h3-14H,1-2H3,(H,25,28)