1H-benzimidazol-2-yl N'-(4-fluorophenyl)carbonylcarbamimidothioate

Systemtic Name: 1H-benzimidazol-2-yl N'-(4-fluorophenyl)carbonylcarbamimidothioate Openeye Name: N-[amino(1H-benzimidazol-2-ylsulfanyl)methylene]-4-fluoro-benzamide CAS Name: N'-[(4-fluorophenyl)-oxomethyl]carbamimidothioic acid 1H-benzimidazol-2-yl ester IUPAC Name: 1H-benzimidazol-2-yl N'-(4-fluorobenzoyl)carbamimidothioate Traditional Name: N-[amino-(1H-benzimidazol-2-ylthio)methylene]-4-fluoro-benzamide Formula: C15H11FN4OS MolecularWeight: 314.337443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SC(=NC(=O)C3=CC=C(C=C3)F)N

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SC(=NC(=O)C3=CC=C(C=C3)F)N

InChI

InChI=1S/C15H11FN4OS/c16-10-7-5-9(6-8-10)13(21)20-14(17)22-15-18-11-3-1-2-4-12(11)19-15/h1-8H,(H,18,19)(H2,17,20,21)