2-(4-fluorophenyl)-N5-(2-methyl-5-methylsulfonyl-phenyl)-3,4-dihydropyrazole-3,5-dicarboxamide

Systemtic Name: 2-(4-fluorophenyl)-N5-(2-methyl-5-methylsulfonyl-phenyl)-3,4-dihydropyrazole-3,5-dicarboxamide Openeye Name: 2-(4-fluorophenyl)-N5-(2-methyl-5-methylsulfonyl-phenyl)-3,4-dihydropyrazole-3,5-dicarboxamide CAS Name: 2-(4-fluorophenyl)-N5-(2-methyl-5-methylsulfonylphenyl)-3,4-dihydropyrazole-3,5-dicarboxamide IUPAC Name: 2-(4-fluorophenyl)-5-N-(2-methyl-5-methylsulfonylphenyl)-3,4-dihydropyrazole-3,5-dicarboxamide Traditional Name: 1-(4-fluorophenyl)-N-(5-mesyl-2-methyl-phenyl)-2-pyrazoline-3,5-dicarboxamide Formula: C19H19FN4O4S MolecularWeight: 418.441963

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19FN4O4S/c1-11-3-8-14(29(2,27)28)9-15(11)22-19(26)16-10-17(18(21)25)24(23-16)13-6-4-12(20)5-7-13/h3-9,17H,10H2,1-2H3,(H2,21,25)(H,22,26)