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

Systemtic Name: N-[4-(1H-benzimidazol-2-yl)phenyl]-2-[(4-nitrophenyl)methylsulfanyl]ethanamide Openeye Name: N-[4-(1H-benzimidazol-2-yl)phenyl]-2-[(4-nitrophenyl)methylsulfanyl]acetamide CAS Name: N-[4-(1H-benzimidazol-2-yl)phenyl]-2-[(4-nitrophenyl)methylthio]acetamide IUPAC Name: N-[4-(1H-benzimidazol-2-yl)phenyl]-2-[(4-nitrophenyl)methylsulfanyl]acetamide Traditional Name: N-[4-(1H-benzimidazol-2-yl)phenyl]-2-[(4-nitrobenzyl)thio]acetamide Formula: C22H18N4O3S MolecularWeight: 418.46832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)NC(=O)CSCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)NC(=O)CSCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H18N4O3S/c27-21(14-30-13-15-5-11-18(12-6-15)26(28)29)23-17-9-7-16(8-10-17)22-24-19-3-1-2-4-20(19)25-22/h1-12H,13-14H2,(H,23,27)(H,24,25)