1-[3-[4-(2-ethylsulfanylphenyl)carbonylpiperazin-1-yl]sulfonylphenyl]ethanone

Systemtic Name: 1-[3-[4-(2-ethylsulfanylphenyl)carbonylpiperazin-1-yl]sulfonylphenyl]ethanone Openeye Name: 1-[3-[4-(2-ethylsulfanylbenzoyl)piperazin-1-yl]sulfonylphenyl]ethanone CAS Name: 1-[3-[[4-[[2-(ethylthio)phenyl]-oxomethyl]-1-piperazinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[3-[4-(2-ethylsulfanylbenzoyl)piperazin-1-yl]sulfonylphenyl]ethanone Traditional Name: 1-[3-[4-[2-(ethylthio)benzoyl]piperazino]sulfonylphenyl]ethanone Formula: C21H24N2O4S2 MolecularWeight: 432.55626

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(=O)C

Isomeric SMILES

CCSC1=CC=CC=C1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C21H24N2O4S2/c1-3-28-20-10-5-4-9-19(20)21(25)22-11-13-23(14-12-22)29(26,27)18-8-6-7-17(15-18)16(2)24/h4-10,15H,3,11-14H2,1-2H3