2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N-[(3-fluorophenyl)methylideneamino]ethanamide

Systemtic Name: 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N-[(3-fluorophenyl)methylideneamino]ethanamide Openeye Name: 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N-[(3-fluorophenyl)methyleneamino]acetamide CAS Name: 2-(1H-benzimidazol-3-ium-2-ylthio)-N-[(3-fluorophenyl)methylideneamino]acetamide IUPAC Name: 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)-N-[(3-fluorophenyl)methylideneamino]acetamide Traditional Name: 2-(1H-benzimidazol-3-ium-2-ylthio)-N-[(3-fluorobenzylidene)amino]acetamide Formula: C16H14FN4OS+ MolecularWeight: 329.371963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=[NH+]2)SCC(=O)NN=CC3=CC(=CC=C3)F

Isomeric SMILES

C1=CC=C2C(=C1)NC(=[NH+]2)SCC(=O)NN=CC3=CC(=CC=C3)F

InChI

InChI=1S/C16H13FN4OS/c17-12-5-3-4-11(8-12)9-18-21-15(22)10-23-16-19-13-6-1-2-7-14(13)20-16/h1-9H,10H2,(H,19,20)(H,21,22)/p+1