N-[2-(1H-indol-3-ylsulfanyl)ethyl]-2-[3-(4-methylphenyl)sulfonylindol-1-yl]ethanamide

Systemtic Name: N-[2-(1H-indol-3-ylsulfanyl)ethyl]-2-[3-(4-methylphenyl)sulfonylindol-1-yl]ethanamide Openeye Name: N-[2-(1H-indol-3-ylsulfanyl)ethyl]-2-[3-(p-tolylsulfonyl)indol-1-yl]acetamide CAS Name: N-[2-(1H-indol-3-ylthio)ethyl]-2-[3-(4-methylphenyl)sulfonyl-1-indolyl]acetamide IUPAC Name: N-[2-(1H-indol-3-ylsulfanyl)ethyl]-2-[3-(4-methylphenyl)sulfonylindol-1-yl]acetamide Traditional Name: N-[2-(1H-indol-3-ylthio)ethyl]-2-(3-tosylindol-1-yl)acetamide Formula: C27H25N3O3S2 MolecularWeight: 503.6357

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)NCCSC4=CNC5=CC=CC=C54

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)NCCSC4=CNC5=CC=CC=C54

InChI

InChI=1S/C27H25N3O3S2/c1-19-10-12-20(13-11-19)35(32,33)26-17-30(24-9-5-3-7-22(24)26)18-27(31)28-14-15-34-25-16-29-23-8-4-2-6-21(23)25/h2-13,16-17,29H,14-15,18H2,1H3,(H,28,31)