4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[(E)-1-pyridin-2-ylethylideneamino]benzamide

Systemtic Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[(E)-1-pyridin-2-ylethylideneamino]benzamide Openeye Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[(E)-1-(2-pyridyl)ethylideneamino]benzamide CAS Name: 4-[(1H-benzimidazol-2-ylthio)methyl]-N-[(E)-1-(2-pyridinyl)ethylideneamino]benzamide IUPAC Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[(E)-1-pyridin-2-ylethylideneamino]benzamide Traditional Name: 4-[(1H-benzimidazol-2-ylthio)methyl]-N-[(E)-1-(2-pyridyl)ethylideneamino]benzamide Formula: C22H19N5OS MolecularWeight: 401.48416

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3N2)C4=CC=CC=N4

Isomeric SMILES

C/C(=N\NC(=O)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3N2)/C4=CC=CC=N4

InChI

InChI=1S/C22H19N5OS/c1-15(18-6-4-5-13-23-18)26-27-21(28)17-11-9-16(10-12-17)14-29-22-24-19-7-2-3-8-20(19)25-22/h2-13H,14H2,1H3,(H,24,25)(H,27,28)/b26-15+