2-[4-methylsulfonyl-1-oxidanylidene-1-[4-(phenylmethyl)piperazin-1-yl]butan-2-yl]-3H-isoindol-1-one

Systemtic Name: 2-[4-methylsulfonyl-1-oxidanylidene-1-[4-(phenylmethyl)piperazin-1-yl]butan-2-yl]-3H-isoindol-1-one Openeye Name: 2-[1-(4-benzylpiperazine-1-carbonyl)-3-methylsulfonyl-propyl]isoindolin-1-one CAS Name: 2-[4-methylsulfonyl-1-oxo-1-[4-(phenylmethyl)-1-piperazinyl]butan-2-yl]-3H-isoindol-1-one IUPAC Name: 2-[1-(4-benzylpiperazin-1-yl)-4-methylsulfonyl-1-oxobutan-2-yl]-3H-isoindol-1-one Traditional Name: 2-[1-(4-benzylpiperazine-1-carbonyl)-3-mesyl-propyl]isoindolin-1-one Formula: C24H29N3O4S MolecularWeight: 455.56976

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)N1CCN(CC1)CC2=CC=CC=C2)N3CC4=CC=CC=C4C3=O

Isomeric SMILES

CS(=O)(=O)CCC(C(=O)N1CCN(CC1)CC2=CC=CC=C2)N3CC4=CC=CC=C4C3=O

InChI

InChI=1S/C24H29N3O4S/c1-32(30,31)16-11-22(27-18-20-9-5-6-10-21(20)23(27)28)24(29)26-14-12-25(13-15-26)17-19-7-3-2-4-8-19/h2-10,22H,11-18H2,1H3