1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]-2-phenylsulfanyl-propan-1-one

Systemtic Name: 1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]-2-phenylsulfanyl-propan-1-one Openeye Name: 2-phenylsulfanyl-1-[4-[(E)-styryl]sulfonylpiperazin-1-yl]propan-1-one CAS Name: 1-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]-2-(phenylthio)-1-propanone IUPAC Name: 1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]-2-phenylsulfanylpropan-1-one Traditional Name: 2-(phenylthio)-1-[4-[(E)-styryl]sulfonylpiperazino]propan-1-one Formula: C21H24N2O3S2 MolecularWeight: 416.55686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)S(=O)(=O)C=CC2=CC=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)N1CCN(CC1)S(=O)(=O)/C=C/C2=CC=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O3S2/c1-18(27-20-10-6-3-7-11-20)21(24)22-13-15-23(16-14-22)28(25,26)17-12-19-8-4-2-5-9-19/h2-12,17-18H,13-16H2,1H3/b17-12+