3-[(5-bromanyl-1-ethanoyl-2,3-dihydroindol-7-yl)sulfonyl]-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-[(5-bromanyl-1-ethanoyl-2,3-dihydroindol-7-yl)sulfonyl]-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 3-(1-acetyl-5-bromo-indolin-7-yl)sulfonyl-1-[4-(2-pyridyl)piperazin-1-yl]propan-1-one CAS Name: 3-[(1-acetyl-5-bromo-2,3-dihydroindol-7-yl)sulfonyl]-1-[4-(2-pyridinyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-[(1-acetyl-5-bromo-2,3-dihydroindol-7-yl)sulfonyl]-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 3-(1-acetyl-5-bromo-indolin-7-yl)sulfonyl-1-[4-(2-pyridyl)piperazino]propan-1-one Formula: C22H25BrN4O4S MolecularWeight: 521.4273

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=CC(=CC(=C21)S(=O)(=O)CCC(=O)N3CCN(CC3)C4=CC=CC=N4)Br

Isomeric SMILES

CC(=O)N1CCC2=CC(=CC(=C21)S(=O)(=O)CCC(=O)N3CCN(CC3)C4=CC=CC=N4)Br

InChI

InChI=1S/C22H25BrN4O4S/c1-16(28)27-8-5-17-14-18(23)15-19(22(17)27)32(30,31)13-6-21(29)26-11-9-25(10-12-26)20-4-2-3-7-24-20/h2-4,7,14-15H,5-6,8-13H2,1H3