N-[(3,4-dimethoxyphenyl)methyl]-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(1-isobutylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[[1-(2-methylpropyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanylacetamide Traditional Name: 2-[(1-isobutylbenzimidazol-2-yl)thio]-N-veratryl-acetamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=CC=CC=C2N=C1SCC(=O)NCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(C)CN1C2=CC=CC=C2N=C1SCC(=O)NCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H27N3O3S/c1-15(2)13-25-18-8-6-5-7-17(18)24-22(25)29-14-21(26)23-12-16-9-10-19(27-3)20(11-16)28-4/h5-11,15H,12-14H2,1-4H3,(H,23,26)