1-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-4-(4-methylsulfanylphenyl)butane-1,4-dione

Systemtic Name: 1-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-4-(4-methylsulfanylphenyl)butane-1,4-dione Openeye Name: 1-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-4-(4-methylsulfanylphenyl)butane-1,4-dione CAS Name: 1-[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]-4-[4-(methylthio)phenyl]butane-1,4-dione IUPAC Name: 1-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-4-(4-methylsulfanylphenyl)butane-1,4-dione Traditional Name: 1-[4-(methylthio)phenyl]-4-(4-p-phenetylsulfonylpiperazino)butane-1,4-dione Formula: C23H28N2O5S2 MolecularWeight: 476.60882

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C23H28N2O5S2/c1-3-30-19-6-10-21(11-7-19)32(28,29)25-16-14-24(15-17-25)23(27)13-12-22(26)18-4-8-20(31-2)9-5-18/h4-11H,3,12-17H2,1-2H3