1-methyl-7-piperazin-1-yl-3-[2-(trifluoromethyl)phenyl]sulfonyl-indole

Systemtic Name: 1-methyl-7-piperazin-1-yl-3-[2-(trifluoromethyl)phenyl]sulfonyl-indole Openeye Name: 1-methyl-7-piperazin-1-yl-3-[2-(trifluoromethyl)phenyl]sulfonyl-indole CAS Name: 1-methyl-7-(1-piperazinyl)-3-[2-(trifluoromethyl)phenyl]sulfonylindole IUPAC Name: 1-methyl-7-piperazin-1-yl-3-[2-(trifluoromethyl)phenyl]sulfonylindole Traditional Name: 1-methyl-7-piperazino-3-[2-(trifluoromethyl)phenyl]sulfonyl-indole Formula: C20H20F3N3O2S MolecularWeight: 423.45191

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C(=CC=C2)N3CCNCC3)S(=O)(=O)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

CN1C=C(C2=C1C(=CC=C2)N3CCNCC3)S(=O)(=O)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C20H20F3N3O2S/c1-25-13-18(29(27,28)17-8-3-2-6-15(17)20(21,22)23)14-5-4-7-16(19(14)25)26-11-9-24-10-12-26/h2-8,13,24H,9-12H2,1H3