2-(5-fluoranyl-2-methyl-1H-indol-3-yl)-1-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(5-fluoranyl-2-methyl-1H-indol-3-yl)-1-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]ethanone Openeye Name: 2-(5-fluoro-2-methyl-1H-indol-3-yl)-1-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]ethanone CAS Name: 2-(5-fluoro-2-methyl-1H-indol-3-yl)-1-[4-(4-methylsulfonyl-2-nitrophenyl)-1-piperazinyl]ethanone IUPAC Name: 2-(5-fluoro-2-methyl-1H-indol-3-yl)-1-[4-(4-methylsulfonyl-2-nitrophenyl)piperazin-1-yl]ethanone Traditional Name: 2-(5-fluoro-2-methyl-1H-indol-3-yl)-1-[4-(4-mesyl-2-nitro-phenyl)piperazino]ethanone Formula: C22H23FN4O5S MolecularWeight: 474.505223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)C=CC(=C2)F)CC(=O)N3CCN(CC3)C4=C(C=C(C=C4)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C2=C(N1)C=CC(=C2)F)CC(=O)N3CCN(CC3)C4=C(C=C(C=C4)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C22H23FN4O5S/c1-14-17(18-11-15(23)3-5-19(18)24-14)13-22(28)26-9-7-25(8-10-26)20-6-4-16(33(2,31)32)12-21(20)27(29)30/h3-6,11-12,24H,7-10,13H2,1-2H3