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

Systemtic Name: 2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N-[(4-methoxy-3-phenylmethoxy-phenyl)methylideneamino]ethanamide Openeye Name: N-[(3-benzyloxy-4-methoxy-phenyl)methyleneamino]-2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetamide CAS Name: 2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)thio]-N-[(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]acetamide IUPAC Name: 2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]-N-[(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]acetamide Traditional Name: N-[(3-benzoxy-4-methoxy-benzylidene)amino]-2-[(3-ethyl-1H-benzimidazol-3-ium-2-yl)thio]acetamide Formula: C26H27N4O3S+ MolecularWeight: 475.58258

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(NC2=CC=CC=C21)SCC(=O)NN=CC3=CC(=C(C=C3)OC)OCC4=CC=CC=C4

Isomeric SMILES

CC[N+]1=C(NC2=CC=CC=C21)SCC(=O)NN=CC3=CC(=C(C=C3)OC)OCC4=CC=CC=C4

InChI

InChI=1S/C26H26N4O3S/c1-3-30-22-12-8-7-11-21(22)28-26(30)34-18-25(31)29-27-16-20-13-14-23(32-2)24(15-20)33-17-19-9-5-4-6-10-19/h4-16H,3,17-18H2,1-2H3,(H,29,31)/p+1