[5-methoxy-1-[3-(trifluoromethyl)phenyl]sulfonyl-indol-2-yl]-(4-methylpiperazin-1-yl)methanone

Systemtic Name: [5-methoxy-1-[3-(trifluoromethyl)phenyl]sulfonyl-indol-2-yl]-(4-methylpiperazin-1-yl)methanone Openeye Name: [5-methoxy-1-[3-(trifluoromethyl)phenyl]sulfonyl-indol-2-yl]-(4-methylpiperazin-1-yl)methanone CAS Name: [5-methoxy-1-[3-(trifluoromethyl)phenyl]sulfonyl-2-indolyl]-(4-methyl-1-piperazinyl)methanone IUPAC Name: [5-methoxy-1-[3-(trifluoromethyl)phenyl]sulfonylindol-2-yl]-(4-methylpiperazin-1-yl)methanone Traditional Name: [5-methoxy-1-[3-(trifluoromethyl)phenyl]sulfonyl-indol-2-yl]-(4-methylpiperazino)methanone Formula: C22H22F3N3O4S MolecularWeight: 481.48799

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=CC3=C(N2S(=O)(=O)C4=CC=CC(=C4)C(F)(F)F)C=CC(=C3)OC

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=CC3=C(N2S(=O)(=O)C4=CC=CC(=C4)C(F)(F)F)C=CC(=C3)OC

InChI

InChI=1S/C22H22F3N3O4S/c1-26-8-10-27(11-9-26)21(29)20-13-15-12-17(32-2)6-7-19(15)28(20)33(30,31)18-5-3-4-16(14-18)22(23,24)25/h3-7,12-14H,8-11H2,1-2H3