2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-1-[(3R)-3-methylpiperidin-1-yl]ethanone

Systemtic Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-1-[(3R)-3-methylpiperidin-1-yl]ethanone Openeye Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-1-[(3R)-3-methyl-1-piperidyl]ethanone CAS Name: 2-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-1-[(3R)-3-methyl-1-piperidinyl]ethanone IUPAC Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-1-[(3R)-3-methylpiperidin-1-yl]ethanone Traditional Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazino]-1-[(3R)-3-methylpiperidino]ethanone Formula: C20H31N3O3S MolecularWeight: 393.54344

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)CN2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)C)C

Isomeric SMILES

C[C@@H]1CCCN(C1)C(=O)CN2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)C)C

InChI

InChI=1S/C20H31N3O3S/c1-16-5-4-8-22(14-16)20(24)15-21-9-11-23(12-10-21)27(25,26)19-7-6-17(2)18(3)13-19/h6-7,13,16H,4-5,8-12,14-15H2,1-3H3/t16-/m1/s1