N-[4-(6-chloranyl-1H-benzimidazol-2-yl)phenyl]-2-[(4-nitrophenyl)methylsulfanyl]ethanamide

Systemtic Name: N-[4-(6-chloranyl-1H-benzimidazol-2-yl)phenyl]-2-[(4-nitrophenyl)methylsulfanyl]ethanamide Openeye Name: N-[4-(6-chloro-1H-benzimidazol-2-yl)phenyl]-2-[(4-nitrophenyl)methylsulfanyl]acetamide CAS Name: N-[4-(6-chloro-1H-benzimidazol-2-yl)phenyl]-2-[(4-nitrophenyl)methylthio]acetamide IUPAC Name: N-[4-(6-chloro-1H-benzimidazol-2-yl)phenyl]-2-[(4-nitrophenyl)methylsulfanyl]acetamide Traditional Name: N-[4-(6-chloro-1H-benzimidazol-2-yl)phenyl]-2-[(4-nitrobenzyl)thio]acetamide Formula: C22H17ClN4O3S MolecularWeight: 452.91338

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSCC(=O)NC2=CC=C(C=C2)C3=NC4=C(N3)C=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CSCC(=O)NC2=CC=C(C=C2)C3=NC4=C(N3)C=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H17ClN4O3S/c23-16-5-10-19-20(11-16)26-22(25-19)15-3-6-17(7-4-15)24-21(28)13-31-12-14-1-8-18(9-2-14)27(29)30/h1-11H,12-13H2,(H,24,28)(H,25,26)