1-[4-[4-[(2S)-butan-2-yl]phenyl]sulfonylpiperazin-1-yl]-2-morpholin-4-yl-ethanone

Systemtic Name: 1-[4-[4-[(2S)-butan-2-yl]phenyl]sulfonylpiperazin-1-yl]-2-morpholin-4-yl-ethanone Openeye Name: 1-[4-[4-[(1S)-1-methylpropyl]phenyl]sulfonylpiperazin-1-yl]-2-morpholino-ethanone CAS Name: 1-[4-[4-[(2S)-butan-2-yl]phenyl]sulfonyl-1-piperazinyl]-2-(4-morpholinyl)ethanone IUPAC Name: 1-[4-[4-[(2S)-butan-2-yl]phenyl]sulfonylpiperazin-1-yl]-2-morpholin-4-ylethanone Traditional Name: 1-[4-[4-[(1S)-1-methylpropyl]phenyl]sulfonylpiperazino]-2-morpholino-ethanone Formula: C20H31N3O4S MolecularWeight: 409.54284

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN3CCOCC3

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN3CCOCC3

InChI

InChI=1S/C20H31N3O4S/c1-3-17(2)18-4-6-19(7-5-18)28(25,26)23-10-8-22(9-11-23)20(24)16-21-12-14-27-15-13-21/h4-7,17H,3,8-16H2,1-2H3/t17-/m0/s1