1-(2,3-dihydroindol-1-yl)-2-(4-methyl-6-piperidin-1-ylsulfonyl-quinolin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(2,3-dihydroindol-1-yl)-2-(4-methyl-6-piperidin-1-ylsulfonyl-quinolin-2-yl)sulfanyl-ethanone Openeye Name: 1-indolin-1-yl-2-[[4-methyl-6-(1-piperidylsulfonyl)-2-quinolyl]sulfanyl]ethanone CAS Name: 1-(2,3-dihydroindol-1-yl)-2-[[4-methyl-6-(1-piperidinylsulfonyl)-2-quinolinyl]thio]ethanone IUPAC Name: 1-(2,3-dihydroindol-1-yl)-2-(4-methyl-6-piperidin-1-ylsulfonylquinolin-2-yl)sulfanylethanone Traditional Name: 1-indolin-1-yl-2-[(4-methyl-6-piperidinosulfonyl-2-quinolyl)thio]ethanone Formula: C25H27N3O3S2 MolecularWeight: 481.63018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=C(C=C2)S(=O)(=O)N3CCCCC3)SCC(=O)N4CCC5=CC=CC=C54

Isomeric SMILES

CC1=CC(=NC2=C1C=C(C=C2)S(=O)(=O)N3CCCCC3)SCC(=O)N4CCC5=CC=CC=C54

InChI

InChI=1S/C25H27N3O3S2/c1-18-15-24(32-17-25(29)28-14-11-19-7-3-4-8-23(19)28)26-22-10-9-20(16-21(18)22)33(30,31)27-12-5-2-6-13-27/h3-4,7-10,15-16H,2,5-6,11-14,17H2,1H3