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

Systemtic Name: N-[(3-bromanyl-4-methoxy-phenyl)methylideneamino]-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]ethanamide Openeye Name: N-[(3-bromo-4-methoxy-phenyl)methyleneamino]-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetamide CAS Name: N-[(3-bromo-4-methoxyphenyl)methylideneamino]-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)thio]acetamide IUPAC Name: N-[(3-bromo-4-methoxyphenyl)methylideneamino]-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetamide Traditional Name: N-[(3-bromo-4-methoxy-benzylidene)amino]-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)thio]acetamide Formula: C18H18BrN4O2S+ MolecularWeight: 434.33012

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC2=CC=CC=C21)SCC(=O)NN=CC3=CC(=C(C=C3)OC)Br

Isomeric SMILES

C[N+]1=C(NC2=CC=CC=C21)SCC(=O)NN=CC3=CC(=C(C=C3)OC)Br

InChI

InChI=1S/C18H17BrN4O2S/c1-23-15-6-4-3-5-14(15)21-18(23)26-11-17(24)22-20-10-12-7-8-16(25-2)13(19)9-12/h3-10H,11H2,1-2H3,(H,22,24)/p+1