N-(1,3-benzodioxol-5-ylmethyl)-5-(4-fluorophenyl)-2-(4-methylphenyl)pyrazole-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(4-fluorophenyl)-2-(4-methylphenyl)pyrazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(4-fluorophenyl)-2-(p-tolyl)pyrazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(4-fluorophenyl)-2-(4-methylphenyl)-3-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-(4-fluorophenyl)-2-(4-methylphenyl)pyrazole-3-carboxamide Traditional Name: 5-(4-fluorophenyl)-N-piperonyl-2-(p-tolyl)pyrazole-3-carboxamide Formula: C25H20FN3O3 MolecularWeight: 429.443003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=C(C=C3)F)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=C(C=C3)F)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H20FN3O3/c1-16-2-9-20(10-3-16)29-22(13-21(28-29)18-5-7-19(26)8-6-18)25(30)27-14-17-4-11-23-24(12-17)32-15-31-23/h2-13H,14-15H2,1H3,(H,27,30)