N-[4-(4-chloranylphenoxy)phenyl]-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[4-(4-chloranylphenoxy)phenyl]-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]ethanamide Openeye Name: N-[4-(4-chlorophenoxy)phenyl]-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetamide CAS Name: N-[4-(4-chlorophenoxy)phenyl]-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)thio]acetamide IUPAC Name: N-[4-(4-chlorophenoxy)phenyl]-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetamide Traditional Name: N-[4-(4-chlorophenoxy)phenyl]-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)thio]acetamide Formula: C22H19ClN3O2S+ MolecularWeight: 424.92316

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC2=CC=CC=C21)SCC(=O)NC3=CC=C(C=C3)OC4=CC=C(C=C4)Cl

Isomeric SMILES

C[N+]1=C(NC2=CC=CC=C21)SCC(=O)NC3=CC=C(C=C3)OC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H18ClN3O2S/c1-26-20-5-3-2-4-19(20)25-22(26)29-14-21(27)24-16-8-12-18(13-9-16)28-17-10-6-15(23)7-11-17/h2-13H,14H2,1H3,(H,24,27)/p+1