N-[[5-(1H-benzimidazol-2-yl)-2-chloranyl-phenyl]carbamothioyl]-2-phenyl-ethanamide

Systemtic Name: N-[[5-(1H-benzimidazol-2-yl)-2-chloranyl-phenyl]carbamothioyl]-2-phenyl-ethanamide Openeye Name: N-[[5-(1H-benzimidazol-2-yl)-2-chloro-phenyl]carbamothioyl]-2-phenyl-acetamide CAS Name: N-[[5-(1H-benzimidazol-2-yl)-2-chloroanilino]-sulfanylidenemethyl]-2-phenylacetamide IUPAC Name: N-[[5-(1H-benzimidazol-2-yl)-2-chlorophenyl]carbamothioyl]-2-phenylacetamide Traditional Name: N-[[5-(1H-benzimidazol-2-yl)-2-chloro-phenyl]thiocarbamoyl]-2-phenyl-acetamide Formula: C22H17ClN4OS MolecularWeight: 420.91458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H17ClN4OS/c23-16-11-10-15(21-24-17-8-4-5-9-18(17)25-21)13-19(16)26-22(29)27-20(28)12-14-6-2-1-3-7-14/h1-11,13H,12H2,(H,24,25)(H2,26,27,28,29)