4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[[2-(dimethylamino)pyridin-4-yl]methyl]benzamide

Systemtic Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[[2-(dimethylamino)pyridin-4-yl]methyl]benzamide Openeye Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[[2-(dimethylamino)-4-pyridyl]methyl]benzamide CAS Name: 4-[(1H-benzimidazol-2-ylthio)methyl]-N-[[2-(dimethylamino)-4-pyridinyl]methyl]benzamide IUPAC Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[[2-(dimethylamino)pyridin-4-yl]methyl]benzamide Traditional Name: 4-[(1H-benzimidazol-2-ylthio)methyl]-N-[[2-(dimethylamino)-4-pyridyl]methyl]benzamide Formula: C23H23N5OS MolecularWeight: 417.52662

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=CC(=C1)CNC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4N3

Isomeric SMILES

CN(C)C1=NC=CC(=C1)CNC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C23H23N5OS/c1-28(2)21-13-17(11-12-24-21)14-25-22(29)18-9-7-16(8-10-18)15-30-23-26-19-5-3-4-6-20(19)27-23/h3-13H,14-15H2,1-2H3,(H,25,29)(H,26,27)