2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-[(2S)-2-methylindolin-1-yl]-1-[4-(p-tolylsulfonyl)piperazin-1-yl]ethanone CAS Name: 2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-[(2S)-2-methylindolin-1-yl]-1-(4-tosylpiperazino)ethanone Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

C[C@H]1CC2=CC=CC=C2N1CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C22H27N3O3S/c1-17-7-9-20(10-8-17)29(27,28)24-13-11-23(12-14-24)22(26)16-25-18(2)15-19-5-3-4-6-21(19)25/h3-10,18H,11-16H2,1-2H3/t18-/m0/s1