4-methyl-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]pentan-1-one

Systemtic Name: 4-methyl-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]pentan-1-one Openeye Name: 4-methyl-1-[4-(p-tolylsulfonyl)piperazin-1-yl]pentan-1-one CAS Name: 4-methyl-1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-1-pentanone IUPAC Name: 4-methyl-1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]pentan-1-one Traditional Name: 4-methyl-1-(4-tosylpiperazino)pentan-1-one Formula: C17H26N2O3S MolecularWeight: 338.46494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC(C)C

InChI

InChI=1S/C17H26N2O3S/c1-14(2)4-9-17(20)18-10-12-19(13-11-18)23(21,22)16-7-5-15(3)6-8-16/h5-8,14H,4,9-13H2,1-3H3