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

Systemtic Name: 1-[(2S)-2-ethylpiperidin-1-yl]-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-[(2S)-2-ethyl-1-piperidyl]-2-[4-(4-isopropylphenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 1-[(2S)-2-ethyl-1-piperidinyl]-2-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 1-[(2S)-2-ethylpiperidin-1-yl]-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 1-[(2S)-2-ethylpiperidino]-2-(4-p-cumenylsulfonylpiperazino)ethanone Formula: C22H35N3O3S MolecularWeight: 421.5966

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)C

Isomeric SMILES

CC[C@H]1CCCCN1C(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C22H35N3O3S/c1-4-20-7-5-6-12-25(20)22(26)17-23-13-15-24(16-14-23)29(27,28)21-10-8-19(9-11-21)18(2)3/h8-11,18,20H,4-7,12-17H2,1-3H3/t20-/m0/s1