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

Systemtic Name: 1-[5-bromanyl-7-[4-(2,5-dimethylphenyl)piperazin-1-yl]sulfonyl-2,3-dihydroindol-1-yl]propan-1-one Openeye Name: 1-[5-bromo-7-[4-(2,5-dimethylphenyl)piperazin-1-yl]sulfonyl-indolin-1-yl]propan-1-one CAS Name: 1-[5-bromo-7-[[4-(2,5-dimethylphenyl)-1-piperazinyl]sulfonyl]-2,3-dihydroindol-1-yl]-1-propanone IUPAC Name: 1-[5-bromo-7-[4-(2,5-dimethylphenyl)piperazin-1-yl]sulfonyl-2,3-dihydroindol-1-yl]propan-1-one Traditional Name: 1-[5-bromo-7-[4-(2,5-dimethylphenyl)piperazino]sulfonyl-indolin-1-yl]propan-1-one Formula: C23H28BrN3O3S MolecularWeight: 506.45572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28BrN3O3S/c1-4-22(28)27-8-7-18-14-19(24)15-21(23(18)27)31(29,30)26-11-9-25(10-12-26)20-13-16(2)5-6-17(20)3/h5-6,13-15H,4,7-12H2,1-3H3