N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-fluoranyl-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-fluoranyl-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-fluoro-5-morpholinosulfonyl-benzamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-fluoro-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-2-fluoro-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-fluoro-5-morpholinosulfonyl-benzamide Formula: C22H25FN4O4S2 MolecularWeight: 492.586703

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)F

Isomeric SMILES

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)F

InChI

InChI=1S/C22H25FN4O4S2/c1-32-13-8-20(21-24-18-4-2-3-5-19(18)25-21)26-22(28)16-14-15(6-7-17(16)23)33(29,30)27-9-11-31-12-10-27/h2-7,14,20H,8-13H2,1H3,(H,24,25)(H,26,28)