N-[2-(3,4-diethoxyphenyl)ethyl]-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[2-(3,4-diethoxyphenyl)ethyl]-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanamide Openeye Name: N-[2-(3,4-diethoxyphenyl)ethyl]-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]acetamide CAS Name: N-[2-(3,4-diethoxyphenyl)ethyl]-2-[(6-methyl-1H-benzimidazol-2-yl)thio]acetamide IUPAC Name: N-[2-(3,4-diethoxyphenyl)ethyl]-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]acetamide Traditional Name: N-[2-(3,4-diethoxyphenyl)ethyl]-2-[(6-methyl-1H-benzimidazol-2-yl)thio]acetamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)CSC2=NC3=C(N2)C=C(C=C3)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)CSC2=NC3=C(N2)C=C(C=C3)C)OCC

InChI

InChI=1S/C22H27N3O3S/c1-4-27-19-9-7-16(13-20(19)28-5-2)10-11-23-21(26)14-29-22-24-17-8-6-15(3)12-18(17)25-22/h6-9,12-13H,4-5,10-11,14H2,1-3H3,(H,23,26)(H,24,25)