N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-1-(2-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-1-(2-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-1-(2-fluorophenyl)sulfonyl-isonipecotamide Formula: C23H27FN4O3S2 MolecularWeight: 490.613883

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4F

Isomeric SMILES

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4F

InChI

InChI=1S/C23H27FN4O3S2/c1-32-15-12-20(22-25-18-7-3-4-8-19(18)26-22)27-23(29)16-10-13-28(14-11-16)33(30,31)21-9-5-2-6-17(21)24/h2-9,16,20H,10-15H2,1H3,(H,25,26)(H,27,29)