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

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-(4-fluorophenyl)-1H-pyrazole-4-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-(4-fluorophenyl)-1H-pyrazole-4-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-(4-fluorophenyl)-1H-pyrazole-4-carboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-(4-fluorophenyl)-1H-pyrazole-4-carboxamide Traditional Name: 5-(4-fluorophenyl)-N-homoveratryl-1H-pyrazole-4-carboxamide Formula: C20H20FN3O3 MolecularWeight: 369.389503

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=C(NN=C2)C3=CC=C(C=C3)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=C(NN=C2)C3=CC=C(C=C3)F)OC

InChI

InChI=1S/C20H20FN3O3/c1-26-17-8-3-13(11-18(17)27-2)9-10-22-20(25)16-12-23-24-19(16)14-4-6-15(21)7-5-14/h3-8,11-12H,9-10H2,1-2H3,(H,22,25)(H,23,24)