N-(2,6-diethylphenyl)-2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2,6-diethylphenyl)-2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(2,6-diethylphenyl)-2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanyl-acetamide CAS Name: N-(2,6-diethylphenyl)-2-[[1-(2-methoxyethyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: N-(2,6-diethylphenyl)-2-[1-(2-methoxyethyl)benzimidazol-2-yl]sulfanylacetamide Traditional Name: N-(2,6-diethylphenyl)-2-[[1-(2-methoxyethyl)benzimidazol-2-yl]thio]acetamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)CSC2=NC3=CC=CC=C3N2CCOC

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)CSC2=NC3=CC=CC=C3N2CCOC

InChI

InChI=1S/C22H27N3O2S/c1-4-16-9-8-10-17(5-2)21(16)24-20(26)15-28-22-23-18-11-6-7-12-19(18)25(22)13-14-27-3/h6-12H,4-5,13-15H2,1-3H3,(H,24,26)