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

Systemtic Name: 3-methylsulfanyl-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 3-methylsulfanyl-1-[4-[(E)-styryl]sulfonylpiperazin-1-yl]propan-1-one CAS Name: 3-(methylthio)-1-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 3-methylsulfanyl-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 3-(methylthio)-1-[4-[(E)-styryl]sulfonylpiperazino]propan-1-one Formula: C16H22N2O3S2 MolecularWeight: 354.48748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O3S2/c1-22-13-7-16(19)17-9-11-18(12-10-17)23(20,21)14-8-15-5-3-2-4-6-15/h2-6,8,14H,7,9-13H2,1H3/b14-8+