N5-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-(4-fluorophenyl)-3,4-dihydropyrazole-3,5-dicarboxamide

Systemtic Name: N5-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-(4-fluorophenyl)-3,4-dihydropyrazole-3,5-dicarboxamide Openeye Name: N5-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-(4-fluorophenyl)-3,4-dihydropyrazole-3,5-dicarboxamide CAS Name: N5-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-(4-fluorophenyl)-3,4-dihydropyrazole-3,5-dicarboxamide IUPAC Name: 5-N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-2-(4-fluorophenyl)-3,4-dihydropyrazole-3,5-dicarboxamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-1-(4-fluorophenyl)-2-pyrazoline-3,5-dicarboxamide Formula: C22H23FN6O2S MolecularWeight: 454.520423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=NN(C(C3)C(=O)N)C4=CC=C(C=C4)F

Isomeric SMILES

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=NN(C(C3)C(=O)N)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H23FN6O2S/c1-32-11-10-17(21-25-15-4-2-3-5-16(15)26-21)27-22(31)18-12-19(20(24)30)29(28-18)14-8-6-13(23)7-9-14/h2-9,17,19H,10-12H2,1H3,(H2,24,30)(H,25,26)(H,27,31)