2-[(2S)-2-methylpiperidin-1-yl]-1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-[(2S)-2-methylpiperidin-1-yl]-1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-[4-(4-isopropylphenyl)sulfonylpiperazin-1-yl]-2-[(2S)-2-methyl-1-piperidyl]ethanone CAS Name: 2-[(2S)-2-methyl-1-piperidinyl]-1-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-[(2S)-2-methylpiperidin-1-yl]-1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-[(2S)-2-methylpiperidino]-1-(4-p-cumenylsulfonylpiperazino)ethanone Formula: C21H33N3O3S MolecularWeight: 407.57002

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)C

Isomeric SMILES

C[C@H]1CCCCN1CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C21H33N3O3S/c1-17(2)19-7-9-20(10-8-19)28(26,27)24-14-12-22(13-15-24)21(25)16-23-11-5-4-6-18(23)3/h7-10,17-18H,4-6,11-16H2,1-3H3/t18-/m0/s1