1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]-2-(4-propan-2-ylphenoxy)ethanone

Systemtic Name: 1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]-2-(4-propan-2-ylphenoxy)ethanone Openeye Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-(4-isopropylphenoxy)ethanone CAS Name: 1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]-2-(4-propan-2-ylphenoxy)ethanone IUPAC Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-(4-propan-2-ylphenoxy)ethanone Traditional Name: 1-(4-benzylsulfonylpiperazino)-2-(4-isopropylphenoxy)ethanone Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O4S/c1-18(2)20-8-10-21(11-9-20)28-16-22(25)23-12-14-24(15-13-23)29(26,27)17-19-6-4-3-5-7-19/h3-11,18H,12-17H2,1-2H3