2-(1H-benzimidazol-2-ylsulfanyl)-N-[(E)-(3-pentoxyphenyl)methylideneamino]ethanamide

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[(E)-(3-pentoxyphenyl)methylideneamino]ethanamide Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[(E)-(3-pentoxyphenyl)methyleneamino]acetamide CAS Name: 2-(1H-benzimidazol-2-ylthio)-N-[(E)-(3-pentoxyphenyl)methylideneamino]acetamide IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[(E)-(3-pentoxyphenyl)methylideneamino]acetamide Traditional Name: N-[(E)-(3-amoxybenzylidene)amino]-2-(1H-benzimidazol-2-ylthio)acetamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC(=C1)C=NNC(=O)CSC2=NC3=CC=CC=C3N2

Isomeric SMILES

CCCCCOC1=CC=CC(=C1)/C=N/NC(=O)CSC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C21H24N4O2S/c1-2-3-6-12-27-17-9-7-8-16(13-17)14-22-25-20(26)15-28-21-23-18-10-4-5-11-19(18)24-21/h4-5,7-11,13-14H,2-3,6,12,15H2,1H3,(H,23,24)(H,25,26)/b22-14+