(2E,4E)-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]hexa-2,4-dien-1-one

Systemtic Name: (2E,4E)-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]hexa-2,4-dien-1-one Openeye Name: (2E,4E)-1-(4-benzylsulfonylpiperazin-1-yl)hexa-2,4-dien-1-one CAS Name: (2E,4E)-1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]-1-hexa-2,4-dienone IUPAC Name: (2E,4E)-1-(4-benzylsulfonylpiperazin-1-yl)hexa-2,4-dien-1-one Traditional Name: (2E,4E)-1-(4-benzylsulfonylpiperazino)hexa-2,4-dien-1-one Formula: C17H22N2O3S MolecularWeight: 334.43318

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N2O3S/c1-2-3-5-10-17(20)18-11-13-19(14-12-18)23(21,22)15-16-8-6-4-7-9-16/h2-10H,11-15H2,1H3/b3-2+,10-5+