N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(2-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(2-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(2-fluorophenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(2-fluorophenyl)-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(2-fluorophenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: 1-(2-fluorophenyl)-N-homoveratryl-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C24H23FN4O3 MolecularWeight: 434.462823

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=C(N(N=C2)C3=CC=CC=C3F)N4C=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=C(N(N=C2)C3=CC=CC=C3F)N4C=CC=C4)OC

InChI

InChI=1S/C24H23FN4O3/c1-31-21-10-9-17(15-22(21)32-2)11-12-26-23(30)18-16-27-29(20-8-4-3-7-19(20)25)24(18)28-13-5-6-14-28/h3-10,13-16H,11-12H2,1-2H3,(H,26,30)