N-[[3-(1H-benzimidazol-2-yl)-4-chloranyl-phenyl]carbamothioyl]-4-ethyl-benzamide

Systemtic Name: N-[[3-(1H-benzimidazol-2-yl)-4-chloranyl-phenyl]carbamothioyl]-4-ethyl-benzamide Openeye Name: N-[[3-(1H-benzimidazol-2-yl)-4-chloro-phenyl]carbamothioyl]-4-ethyl-benzamide CAS Name: N-[[3-(1H-benzimidazol-2-yl)-4-chloroanilino]-sulfanylidenemethyl]-4-ethylbenzamide IUPAC Name: N-[[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]carbamothioyl]-4-ethylbenzamide Traditional Name: N-[[3-(1H-benzimidazol-2-yl)-4-chloro-phenyl]thiocarbamoyl]-4-ethyl-benzamide Formula: C23H19ClN4OS MolecularWeight: 434.94116

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)Cl)C3=NC4=CC=CC=C4N3

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)Cl)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C23H19ClN4OS/c1-2-14-7-9-15(10-8-14)22(29)28-23(30)25-16-11-12-18(24)17(13-16)21-26-19-5-3-4-6-20(19)27-21/h3-13H,2H2,1H3,(H,26,27)(H2,25,28,29,30)