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

Systemtic Name: 1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]-4-phenylsulfanyl-butan-1-one Openeye Name: 4-phenylsulfanyl-1-[4-[(E)-styryl]sulfonylpiperazin-1-yl]butan-1-one CAS Name: 1-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]-4-(phenylthio)-1-butanone IUPAC Name: 1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]-4-phenylsulfanylbutan-1-one Traditional Name: 4-(phenylthio)-1-[4-[(E)-styryl]sulfonylpiperazino]butan-1-one Formula: C22H26N2O3S2 MolecularWeight: 430.58344

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCCSC2=CC=CC=C2)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)CCCSC2=CC=CC=C2)S(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C22H26N2O3S2/c25-22(12-7-18-28-21-10-5-2-6-11-21)23-14-16-24(17-15-23)29(26,27)19-13-20-8-3-1-4-9-20/h1-6,8-11,13,19H,7,12,14-18H2/b19-13+