2-(1H-benzimidazol-2-ylsulfanyl)-N-[(E)-(4-hexoxy-3-methoxy-phenyl)methylideneamino]ethanamide

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[(E)-(4-hexoxy-3-methoxy-phenyl)methylideneamino]ethanamide Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[(E)-(4-hexoxy-3-methoxy-phenyl)methyleneamino]acetamide CAS Name: 2-(1H-benzimidazol-2-ylthio)-N-[(E)-(4-hexoxy-3-methoxyphenyl)methylideneamino]acetamide IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[(E)-(4-hexoxy-3-methoxyphenyl)methylideneamino]acetamide Traditional Name: 2-(1H-benzimidazol-2-ylthio)-N-[(E)-(4-hexoxy-3-methoxy-benzylidene)amino]acetamide Formula: C23H28N4O3S MolecularWeight: 440.55842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C=NNC(=O)CSC2=NC3=CC=CC=C3N2)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)/C=N/NC(=O)CSC2=NC3=CC=CC=C3N2)OC

InChI

InChI=1S/C23H28N4O3S/c1-3-4-5-8-13-30-20-12-11-17(14-21(20)29-2)15-24-27-22(28)16-31-23-25-18-9-6-7-10-19(18)26-23/h6-7,9-12,14-15H,3-5,8,13,16H2,1-2H3,(H,25,26)(H,27,28)/b24-15+