N-(2,5-dimethoxyphenyl)-2-[1-[(4-methylphenyl)methyl]indol-3-yl]sulfanyl-ethanamide

Systemtic Name: N-(2,5-dimethoxyphenyl)-2-[1-[(4-methylphenyl)methyl]indol-3-yl]sulfanyl-ethanamide Openeye Name: N-(2,5-dimethoxyphenyl)-2-[1-(p-tolylmethyl)indol-3-yl]sulfanyl-acetamide CAS Name: N-(2,5-dimethoxyphenyl)-2-[[1-[(4-methylphenyl)methyl]-3-indolyl]thio]acetamide IUPAC Name: N-(2,5-dimethoxyphenyl)-2-[1-[(4-methylphenyl)methyl]indol-3-yl]sulfanylacetamide Traditional Name: N-(2,5-dimethoxyphenyl)-2-[[1-(4-methylbenzyl)indol-3-yl]thio]acetamide Formula: C26H26N2O3S MolecularWeight: 446.56124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)SCC(=O)NC4=C(C=CC(=C4)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)SCC(=O)NC4=C(C=CC(=C4)OC)OC

InChI

InChI=1S/C26H26N2O3S/c1-18-8-10-19(11-9-18)15-28-16-25(21-6-4-5-7-23(21)28)32-17-26(29)27-22-14-20(30-2)12-13-24(22)31-3/h4-14,16H,15,17H2,1-3H3,(H,27,29)