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

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[1-(3-methylbutyl)benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(1-isopentylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[[1-(3-methylbutyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[1-(3-methylbutyl)benzimidazol-2-yl]sulfanylacetamide Traditional Name: 2-[(1-isoamylbenzimidazol-2-yl)thio]-N-veratryl-acetamide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=CC=CC=C2N=C1SCC(=O)NCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(C)CCN1C2=CC=CC=C2N=C1SCC(=O)NCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C23H29N3O3S/c1-16(2)11-12-26-19-8-6-5-7-18(19)25-23(26)30-15-22(27)24-14-17-9-10-20(28-3)21(13-17)29-4/h5-10,13,16H,11-12,14-15H2,1-4H3,(H,24,27)