1-[4-[1-(2,4-dimethylphenyl)sulfonylpiperidin-4-yl]carbonylpiperazin-1-yl]-3-methyl-butan-1-one

Systemtic Name: 1-[4-[1-(2,4-dimethylphenyl)sulfonylpiperidin-4-yl]carbonylpiperazin-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[4-[1-(2,4-dimethylphenyl)sulfonylpiperidine-4-carbonyl]piperazin-1-yl]-3-methyl-butan-1-one CAS Name: 1-[4-[[1-(2,4-dimethylphenyl)sulfonyl-4-piperidinyl]-oxomethyl]-1-piperazinyl]-3-methyl-1-butanone IUPAC Name: 1-[4-[1-(2,4-dimethylphenyl)sulfonylpiperidine-4-carbonyl]piperazin-1-yl]-3-methylbutan-1-one Traditional Name: 1-[4-[1-(2,4-dimethylphenyl)sulfonylisonipecotoyl]piperazino]-3-methyl-butan-1-one Formula: C23H35N3O4S MolecularWeight: 449.6067

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCN(CC3)C(=O)CC(C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCN(CC3)C(=O)CC(C)C)C

InChI

InChI=1S/C23H35N3O4S/c1-17(2)15-22(27)24-11-13-25(14-12-24)23(28)20-7-9-26(10-8-20)31(29,30)21-6-5-18(3)16-19(21)4/h5-6,16-17,20H,7-15H2,1-4H3