4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-(pyridin-4-ylmethylideneamino)benzamide

Systemtic Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-(pyridin-4-ylmethylideneamino)benzamide Openeye Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-(4-pyridylmethyleneamino)benzamide CAS Name: 4-[(1H-benzimidazol-2-ylthio)methyl]-N-(pyridin-4-ylmethylideneamino)benzamide IUPAC Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-(pyridin-4-ylmethylideneamino)benzamide Traditional Name: 4-[(1H-benzimidazol-2-ylthio)methyl]-N-(4-pyridylmethyleneamino)benzamide Formula: C21H17N5OS MolecularWeight: 387.45758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SCC3=CC=C(C=C3)C(=O)NN=CC4=CC=NC=C4

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SCC3=CC=C(C=C3)C(=O)NN=CC4=CC=NC=C4

InChI

InChI=1S/C21H17N5OS/c27-20(26-23-13-15-9-11-22-12-10-15)17-7-5-16(6-8-17)14-28-21-24-18-3-1-2-4-19(18)25-21/h1-13H,14H2,(H,24,25)(H,26,27)