N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[3-(4-methylphenyl)sulfonylindol-1-yl]ethanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[3-(4-methylphenyl)sulfonylindol-1-yl]ethanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[3-(p-tolylsulfonyl)indol-1-yl]acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[3-(4-methylphenyl)sulfonyl-1-indolyl]acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[3-(4-methylphenyl)sulfonylindol-1-yl]acetamide Traditional Name: N-homoveratryl-2-(3-tosylindol-1-yl)acetamide Formula: C27H28N2O5S MolecularWeight: 492.58662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)NCCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)NCCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H28N2O5S/c1-19-8-11-21(12-9-19)35(31,32)26-17-29(23-7-5-4-6-22(23)26)18-27(30)28-15-14-20-10-13-24(33-2)25(16-20)34-3/h4-13,16-17H,14-15,18H2,1-3H3,(H,28,30)