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

Systemtic Name: (E)-1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]but-2-en-1-one Openeye Name: (E)-1-[4-(4-isopropylphenyl)sulfonylpiperazin-1-yl]but-2-en-1-one CAS Name: (E)-1-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]-2-buten-1-one IUPAC Name: (E)-1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]but-2-en-1-one Traditional Name: (E)-1-(4-p-cumenylsulfonylpiperazino)but-2-en-1-one Formula: C17H24N2O3S MolecularWeight: 336.44906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24N2O3S/c1-4-5-17(20)18-10-12-19(13-11-18)23(21,22)16-8-6-15(7-9-16)14(2)3/h4-9,14H,10-13H2,1-3H3/b5-4+