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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=CC(=CC(=C21)S(=O)(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5)Br

Isomeric SMILES

CCC(=O)N1CCC2=CC(=CC(=C21)S(=O)(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5)Br

InChI

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