2-[2-[(2-chlorophenyl)methylsulfanyl]benzimidazol-1-yl]-1-(4-nitrophenyl)ethanone

Systemtic Name: 2-[2-[(2-chlorophenyl)methylsulfanyl]benzimidazol-1-yl]-1-(4-nitrophenyl)ethanone Openeye Name: 2-[2-[(2-chlorophenyl)methylsulfanyl]benzimidazol-1-yl]-1-(4-nitrophenyl)ethanone CAS Name: 2-[2-[(2-chlorophenyl)methylthio]-1-benzimidazolyl]-1-(4-nitrophenyl)ethanone IUPAC Name: 2-[2-[(2-chlorophenyl)methylsulfanyl]benzimidazol-1-yl]-1-(4-nitrophenyl)ethanone Traditional Name: 2-[2-[(2-chlorobenzyl)thio]benzimidazol-1-yl]-1-(4-nitrophenyl)ethanone Formula: C22H16ClN3O3S MolecularWeight: 437.89874

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=NC3=CC=CC=C3N2CC(=O)C4=CC=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=NC3=CC=CC=C3N2CC(=O)C4=CC=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C22H16ClN3O3S/c23-18-6-2-1-5-16(18)14-30-22-24-19-7-3-4-8-20(19)25(22)13-21(27)15-9-11-17(12-10-15)26(28)29/h1-12H,13-14H2