5-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-2-(4-fluorophenyl)-3,4-dihydropyrazole-3-carboxamide

Systemtic Name: 5-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-2-(4-fluorophenyl)-3,4-dihydropyrazole-3-carboxamide Openeye Name: 5-[4-(3-chlorophenyl)piperazine-1-carbonyl]-2-(4-fluorophenyl)-3,4-dihydropyrazole-3-carboxamide CAS Name: 5-[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]-2-(4-fluorophenyl)-3,4-dihydropyrazole-3-carboxamide IUPAC Name: 5-[4-(3-chlorophenyl)piperazine-1-carbonyl]-2-(4-fluorophenyl)-3,4-dihydropyrazole-3-carboxamide Traditional Name: 5-[4-(3-chlorophenyl)piperazine-1-carbonyl]-2-(4-fluorophenyl)-2-pyrazoline-3-carboxamide Formula: C21H21ClFN5O2 MolecularWeight: 429.875143

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)C3=NN(C(C3)C(=O)N)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)C3=NN(C(C3)C(=O)N)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H21ClFN5O2/c22-14-2-1-3-17(12-14)26-8-10-27(11-9-26)21(30)18-13-19(20(24)29)28(25-18)16-6-4-15(23)5-7-16/h1-7,12,19H,8-11,13H2,(H2,24,29)