2-(4-fluorophenyl)-N5-(5-methylhexan-2-yl)-3,4-dihydropyrazole-3,5-dicarboxamide

Systemtic Name: 2-(4-fluorophenyl)-N5-(5-methylhexan-2-yl)-3,4-dihydropyrazole-3,5-dicarboxamide Openeye Name: N5-(1,4-dimethylpentyl)-2-(4-fluorophenyl)-3,4-dihydropyrazole-3,5-dicarboxamide CAS Name: 2-(4-fluorophenyl)-N5-(5-methylhexan-2-yl)-3,4-dihydropyrazole-3,5-dicarboxamide IUPAC Name: 2-(4-fluorophenyl)-5-N-(5-methylhexan-2-yl)-3,4-dihydropyrazole-3,5-dicarboxamide Traditional Name: N-(1,4-dimethylpentyl)-1-(4-fluorophenyl)-2-pyrazoline-3,5-dicarboxamide Formula: C18H25FN4O2 MolecularWeight: 348.415103

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)NC(=O)C1=NN(C(C1)C(=O)N)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)CCC(C)NC(=O)C1=NN(C(C1)C(=O)N)C2=CC=C(C=C2)F

InChI

InChI=1S/C18H25FN4O2/c1-11(2)4-5-12(3)21-18(25)15-10-16(17(20)24)23(22-15)14-8-6-13(19)7-9-14/h6-9,11-12,16H,4-5,10H2,1-3H3,(H2,20,24)(H,21,25)