N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-4-(1,3-dithiolan-2-yl)benzamide

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-4-(1,3-dithiolan-2-yl)benzamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-4-(1,3-dithiolan-2-yl)benzamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-4-(1,3-dithiolan-2-yl)benzamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-4-(1,3-dithiolan-2-yl)benzamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-4-(1,3-dithiolan-2-yl)benzamide Formula: C21H23N3OS3 MolecularWeight: 429.62182

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC=C(C=C3)C4SCCS4

Isomeric SMILES

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC=C(C=C3)C4SCCS4

InChI

InChI=1S/C21H23N3OS3/c1-26-11-10-18(19-22-16-4-2-3-5-17(16)23-19)24-20(25)14-6-8-15(9-7-14)21-27-12-13-28-21/h2-9,18,21H,10-13H2,1H3,(H,22,23)(H,24,25)