N-[2-(1H-indol-3-yl)ethyl]-2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[2-(1H-indol-3-yl)ethyl]-2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-[2-(1H-indol-3-yl)ethyl]-2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanyl-acetamide CAS Name: N-[2-(1H-indol-3-yl)ethyl]-2-[[1-(3-methoxyphenyl)-2-imidazolyl]thio]acetamide IUPAC Name: N-[2-(1H-indol-3-yl)ethyl]-2-[1-(3-methoxyphenyl)imidazol-2-yl]sulfanylacetamide Traditional Name: N-[2-(1H-indol-3-yl)ethyl]-2-[[1-(3-methoxyphenyl)imidazol-2-yl]thio]acetamide Formula: C22H22N4O2S MolecularWeight: 406.50068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C=CN=C2SCC(=O)NCCC3=CNC4=CC=CC=C43

Isomeric SMILES

COC1=CC=CC(=C1)N2C=CN=C2SCC(=O)NCCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C22H22N4O2S/c1-28-18-6-4-5-17(13-18)26-12-11-24-22(26)29-15-21(27)23-10-9-16-14-25-20-8-3-2-7-19(16)20/h2-8,11-14,25H,9-10,15H2,1H3,(H,23,27)