4-methyl-1-[4-[[2-methyl-1-(4-methylsulfonylphenyl)pentan-3-yl]amino]butyl]piperazin-2-one

Systemtic Name: 4-methyl-1-[4-[[2-methyl-1-(4-methylsulfonylphenyl)pentan-3-yl]amino]butyl]piperazin-2-one Openeye Name: 1-[4-[[1-ethyl-2-methyl-3-(4-methylsulfonylphenyl)propyl]amino]butyl]-4-methyl-piperazin-2-one CAS Name: 4-methyl-1-[4-[[2-methyl-1-(4-methylsulfonylphenyl)pentan-3-yl]amino]butyl]-2-piperazinone IUPAC Name: 4-methyl-1-[4-[[2-methyl-1-(4-methylsulfonylphenyl)pentan-3-yl]amino]butyl]piperazin-2-one Traditional Name: 1-[4-[[1-ethyl-3-(4-mesylphenyl)-2-methyl-propyl]amino]butyl]-4-methyl-piperazin-2-one Formula: C22H37N3O3S MolecularWeight: 423.61248

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C)CC1=CC=C(C=C1)S(=O)(=O)C)NCCCCN2CCN(CC2=O)C

Isomeric SMILES

CCC(C(C)CC1=CC=C(C=C1)S(=O)(=O)C)NCCCCN2CCN(CC2=O)C

InChI

InChI=1S/C22H37N3O3S/c1-5-21(18(2)16-19-8-10-20(11-9-19)29(4,27)28)23-12-6-7-13-25-15-14-24(3)17-22(25)26/h8-11,18,21,23H,5-7,12-17H2,1-4H3