2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-1-[4-[(E)-styryl]sulfonylpiperazin-1-yl]ethanone CAS Name: 2-[(1-oxido-2-pyridin-1-iumyl)thio]-1-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-1-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-[(1-oxidopyridin-1-ium-2-yl)thio]-1-[4-[(E)-styryl]sulfonylpiperazino]ethanone Formula: C19H21N3O4S2 MolecularWeight: 419.51774

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CSC2=CC=CC=[N+]2[O-])S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)CSC2=CC=CC=[N+]2[O-])S(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C19H21N3O4S2/c23-18(16-27-19-8-4-5-10-22(19)24)20-11-13-21(14-12-20)28(25,26)15-9-17-6-2-1-3-7-17/h1-10,15H,11-14,16H2/b15-9+