1-[7-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonyl-5-bromanyl-2-methyl-2,3-dihydroindol-1-yl]ethanone

Systemtic Name: 1-[7-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonyl-5-bromanyl-2-methyl-2,3-dihydroindol-1-yl]ethanone Openeye Name: 1-[7-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonyl-5-bromo-2-methyl-indolin-1-yl]ethanone CAS Name: 1-[7-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]sulfonyl]-5-bromo-2-methyl-2,3-dihydroindol-1-yl]ethanone IUPAC Name: 1-[7-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]sulfonyl-5-bromo-2-methyl-2,3-dihydroindol-1-yl]ethanone Traditional Name: 1-[5-bromo-2-methyl-7-(4-piperonylpiperazino)sulfonyl-indolin-1-yl]ethanone Formula: C23H26BrN3O5S MolecularWeight: 536.43864

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC(=CC(=C2N1C(=O)C)S(=O)(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5)Br

Isomeric SMILES

CC1CC2=CC(=CC(=C2N1C(=O)C)S(=O)(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5)Br

InChI

InChI=1S/C23H26BrN3O5S/c1-15-9-18-11-19(24)12-22(23(18)27(15)16(2)28)33(29,30)26-7-5-25(6-8-26)13-17-3-4-20-21(10-17)32-14-31-20/h3-4,10-12,15H,5-9,13-14H2,1-2H3