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

Systemtic Name: N-[2-(1H-indol-3-yl)ethyl]-2-[1-(2-methylphenyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-[2-(1H-indol-3-yl)ethyl]-2-[1-(o-tolyl)imidazol-2-yl]sulfanyl-acetamide CAS Name: N-[2-(1H-indol-3-yl)ethyl]-2-[[1-(2-methylphenyl)-2-imidazolyl]thio]acetamide IUPAC Name: N-[2-(1H-indol-3-yl)ethyl]-2-[1-(2-methylphenyl)imidazol-2-yl]sulfanylacetamide Traditional Name: N-[2-(1H-indol-3-yl)ethyl]-2-[[1-(o-tolyl)imidazol-2-yl]thio]acetamide Formula: C22H22N4OS MolecularWeight: 390.50128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=CN=C2SCC(=O)NCCC3=CNC4=CC=CC=C43

Isomeric SMILES

CC1=CC=CC=C1N2C=CN=C2SCC(=O)NCCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C22H22N4OS/c1-16-6-2-5-9-20(16)26-13-12-24-22(26)28-15-21(27)23-11-10-17-14-25-19-8-4-3-7-18(17)19/h2-9,12-14,25H,10-11,15H2,1H3,(H,23,27)