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

Systemtic Name: 1-[4-[4-[(2S)-butan-2-yl]phenyl]sulfonylpiperazin-1-yl]-2-phenyl-ethanone Openeye Name: 1-[4-[4-[(1S)-1-methylpropyl]phenyl]sulfonylpiperazin-1-yl]-2-phenyl-ethanone CAS Name: 1-[4-[4-[(2S)-butan-2-yl]phenyl]sulfonyl-1-piperazinyl]-2-phenylethanone IUPAC Name: 1-[4-[4-[(2S)-butan-2-yl]phenyl]sulfonylpiperazin-1-yl]-2-phenylethanone Traditional Name: 1-[4-[4-[(1S)-1-methylpropyl]phenyl]sulfonylpiperazino]-2-phenyl-ethanone Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CC3=CC=CC=C3

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CC3=CC=CC=C3

InChI

InChI=1S/C22H28N2O3S/c1-3-18(2)20-9-11-21(12-10-20)28(26,27)24-15-13-23(14-16-24)22(25)17-19-7-5-4-6-8-19/h4-12,18H,3,13-17H2,1-2H3/t18-/m0/s1