2-[3-[(2,5-dimethylphenyl)methylsulfonyl]indol-1-yl]-N-phenethyl-ethanamide

Systemtic Name: 2-[3-[(2,5-dimethylphenyl)methylsulfonyl]indol-1-yl]-N-phenethyl-ethanamide Openeye Name: 2-[3-[(2,5-dimethylphenyl)methylsulfonyl]indol-1-yl]-N-phenethyl-acetamide CAS Name: 2-[3-[(2,5-dimethylphenyl)methylsulfonyl]-1-indolyl]-N-phenethylacetamide IUPAC Name: 2-[3-[(2,5-dimethylphenyl)methylsulfonyl]indol-1-yl]-N-phenethylacetamide Traditional Name: 2-[3-(2,5-dimethylbenzyl)sulfonylindol-1-yl]-N-phenethyl-acetamide Formula: C27H28N2O3S MolecularWeight: 460.58782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H28N2O3S/c1-20-12-13-21(2)23(16-20)19-33(31,32)26-17-29(25-11-7-6-10-24(25)26)18-27(30)28-15-14-22-8-4-3-5-9-22/h3-13,16-17H,14-15,18-19H2,1-2H3,(H,28,30)