3-phenyl-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]butan-1-one

Systemtic Name: 3-phenyl-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]butan-1-one Openeye Name: 3-phenyl-1-[4-[(E)-styryl]sulfonylpiperazin-1-yl]butan-1-one CAS Name: 3-phenyl-1-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]-1-butanone IUPAC Name: 3-phenyl-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]butan-1-one Traditional Name: 3-phenyl-1-[4-[(E)-styryl]sulfonylpiperazino]butan-1-one Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)N1CCN(CC1)S(=O)(=O)C=CC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(CC(=O)N1CCN(CC1)S(=O)(=O)/C=C/C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H26N2O3S/c1-19(21-10-6-3-7-11-21)18-22(25)23-13-15-24(16-14-23)28(26,27)17-12-20-8-4-2-5-9-20/h2-12,17,19H,13-16,18H2,1H3/b17-12+