(E)-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]but-2-en-1-one

Systemtic Name: (E)-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]but-2-en-1-one Openeye Name: (E)-1-(4-benzylsulfonylpiperazin-1-yl)but-2-en-1-one CAS Name: (E)-1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]-2-buten-1-one IUPAC Name: (E)-1-(4-benzylsulfonylpiperazin-1-yl)but-2-en-1-one Traditional Name: (E)-1-(4-benzylsulfonylpiperazino)but-2-en-1-one Formula: C15H20N2O3S MolecularWeight: 308.3959

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)N1CCN(CC1)S(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

C/C=C/C(=O)N1CCN(CC1)S(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C15H20N2O3S/c1-2-6-15(18)16-9-11-17(12-10-16)21(19,20)13-14-7-4-3-5-8-14/h2-8H,9-13H2,1H3/b6-2+