N-[[3-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-2-iodanyl-benzamide

Systemtic Name: N-[[3-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-2-iodanyl-benzamide Openeye Name: N-[[3-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-2-iodo-benzamide CAS Name: N-[[3-(1H-benzimidazol-2-yl)anilino]-sulfanylidenemethyl]-2-iodobenzamide IUPAC Name: N-[[3-(1H-benzimidazol-2-yl)phenyl]carbamothioyl]-2-iodobenzamide Traditional Name: N-[[3-(1H-benzimidazol-2-yl)phenyl]thiocarbamoyl]-2-iodo-benzamide Formula: C21H15IN4OS MolecularWeight: 498.33947

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4N3)I

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4N3)I

InChI

InChI=1S/C21H15IN4OS/c22-16-9-2-1-8-15(16)20(27)26-21(28)23-14-7-5-6-13(12-14)19-24-17-10-3-4-11-18(17)25-19/h1-12H,(H,24,25)(H2,23,26,27,28)