2-(4-fluorophenyl)-N5-[2-(4-methylphenoxy)ethyl]-3,4-dihydropyrazole-3,5-dicarboxamide

Systemtic Name: 2-(4-fluorophenyl)-N5-[2-(4-methylphenoxy)ethyl]-3,4-dihydropyrazole-3,5-dicarboxamide Openeye Name: 2-(4-fluorophenyl)-N5-[2-(4-methylphenoxy)ethyl]-3,4-dihydropyrazole-3,5-dicarboxamide CAS Name: 2-(4-fluorophenyl)-N5-[2-(4-methylphenoxy)ethyl]-3,4-dihydropyrazole-3,5-dicarboxamide IUPAC Name: 2-(4-fluorophenyl)-5-N-[2-(4-methylphenoxy)ethyl]-3,4-dihydropyrazole-3,5-dicarboxamide Traditional Name: 1-(4-fluorophenyl)-N-[2-(4-methylphenoxy)ethyl]-2-pyrazoline-3,5-dicarboxamide Formula: C20H21FN4O3 MolecularWeight: 384.404143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCNC(=O)C2=NN(C(C2)C(=O)N)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)OCCNC(=O)C2=NN(C(C2)C(=O)N)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H21FN4O3/c1-13-2-8-16(9-3-13)28-11-10-23-20(27)17-12-18(19(22)26)25(24-17)15-6-4-14(21)5-7-15/h2-9,18H,10-12H2,1H3,(H2,22,26)(H,23,27)