2-(5-bromanyl-2-methyl-1H-indol-3-yl)-1-(4-pyridin-3-ylsulfonylpiperazin-1-yl)ethanone

Systemtic Name: 2-(5-bromanyl-2-methyl-1H-indol-3-yl)-1-(4-pyridin-3-ylsulfonylpiperazin-1-yl)ethanone Openeye Name: 2-(5-bromo-2-methyl-1H-indol-3-yl)-1-[4-(3-pyridylsulfonyl)piperazin-1-yl]ethanone CAS Name: 2-(5-bromo-2-methyl-1H-indol-3-yl)-1-[4-(3-pyridinylsulfonyl)-1-piperazinyl]ethanone IUPAC Name: 2-(5-bromo-2-methyl-1H-indol-3-yl)-1-(4-pyridin-3-ylsulfonylpiperazin-1-yl)ethanone Traditional Name: 2-(5-bromo-2-methyl-1H-indol-3-yl)-1-[4-(3-pyridylsulfonyl)piperazino]ethanone Formula: C20H21BrN4O3S MolecularWeight: 477.37474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)C=CC(=C2)Br)CC(=O)N3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

CC1=C(C2=C(N1)C=CC(=C2)Br)CC(=O)N3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C20H21BrN4O3S/c1-14-17(18-11-15(21)4-5-19(18)23-14)12-20(26)24-7-9-25(10-8-24)29(27,28)16-3-2-6-22-13-16/h2-6,11,13,23H,7-10,12H2,1H3