2-[1-(4-methylsulfonylpiperazin-1-yl)-1-oxidanylidene-propan-2-yl]-3H-isoindol-1-one

Systemtic Name: 2-[1-(4-methylsulfonylpiperazin-1-yl)-1-oxidanylidene-propan-2-yl]-3H-isoindol-1-one Openeye Name: 2-[1-methyl-2-(4-methylsulfonylpiperazin-1-yl)-2-oxo-ethyl]isoindolin-1-one CAS Name: 2-[1-(4-methylsulfonyl-1-piperazinyl)-1-oxopropan-2-yl]-3H-isoindol-1-one IUPAC Name: 2-[1-(4-methylsulfonylpiperazin-1-yl)-1-oxopropan-2-yl]-3H-isoindol-1-one Traditional Name: 2-[2-keto-2-(4-mesylpiperazino)-1-methyl-ethyl]isoindolin-1-one Formula: C16H21N3O4S MolecularWeight: 351.42064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)S(=O)(=O)C)N2CC3=CC=CC=C3C2=O

Isomeric SMILES

CC(C(=O)N1CCN(CC1)S(=O)(=O)C)N2CC3=CC=CC=C3C2=O

InChI

InChI=1S/C16H21N3O4S/c1-12(19-11-13-5-3-4-6-14(13)16(19)21)15(20)17-7-9-18(10-8-17)24(2,22)23/h3-6,12H,7-11H2,1-2H3