1-[4-(3-ethanoylphenyl)sulfonylpiperazin-1-yl]-2-(phenylmethylsulfanyl)propan-1-one

Systemtic Name: 1-[4-(3-ethanoylphenyl)sulfonylpiperazin-1-yl]-2-(phenylmethylsulfanyl)propan-1-one Openeye Name: 1-[4-(3-acetylphenyl)sulfonylpiperazin-1-yl]-2-benzylsulfanyl-propan-1-one CAS Name: 1-[4-(3-acetylphenyl)sulfonyl-1-piperazinyl]-2-(phenylmethylthio)-1-propanone IUPAC Name: 1-[4-(3-acetylphenyl)sulfonylpiperazin-1-yl]-2-benzylsulfanylpropan-1-one Traditional Name: 1-[4-(3-acetylphenyl)sulfonylpiperazino]-2-(benzylthio)propan-1-one Formula: C22H26N2O4S2 MolecularWeight: 446.58284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)C)SCC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)C)SCC3=CC=CC=C3

InChI

InChI=1S/C22H26N2O4S2/c1-17(25)20-9-6-10-21(15-20)30(27,28)24-13-11-23(12-14-24)22(26)18(2)29-16-19-7-4-3-5-8-19/h3-10,15,18H,11-14,16H2,1-2H3