2-(1H-benzimidazol-2-ylsulfanyl)-N-[2-(3,4-diethoxyphenyl)ethyl]ethanamide

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[2-(3,4-diethoxyphenyl)ethyl]ethanamide Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide CAS Name: 2-(1H-benzimidazol-2-ylthio)-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide Traditional Name: 2-(1H-benzimidazol-2-ylthio)-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)CSC2=NC3=CC=CC=C3N2)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)CSC2=NC3=CC=CC=C3N2)OCC

InChI

InChI=1S/C21H25N3O3S/c1-3-26-18-10-9-15(13-19(18)27-4-2)11-12-22-20(25)14-28-21-23-16-7-5-6-8-17(16)24-21/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,22,25)(H,23,24)