N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(phenylsulfonylmethyl)benzamide

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(phenylsulfonylmethyl)benzamide Openeye Name: 3-(benzenesulfonylmethyl)-N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]benzamide CAS Name: 3-(benzenesulfonylmethyl)-N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]benzamide IUPAC Name: 3-(benzenesulfonylmethyl)-N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]benzamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-(besylmethyl)benzamide Formula: C25H25N3O3S2 MolecularWeight: 479.6143

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC(=CC=C3)CS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CSCC[C@@H](C1=NC2=CC=CC=C2N1)NC(=O)C3=CC(=CC=C3)CS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H25N3O3S2/c1-32-15-14-23(24-26-21-12-5-6-13-22(21)27-24)28-25(29)19-9-7-8-18(16-19)17-33(30,31)20-10-3-2-4-11-20/h2-13,16,23H,14-15,17H2,1H3,(H,26,27)(H,28,29)/t23-/m0/s1