1-[4-[4-(5-methylsulfonyl-2-thiophen-3-yl-phenyl)carbonylpiperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-(5-methylsulfonyl-2-thiophen-3-yl-phenyl)carbonylpiperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-[5-methylsulfonyl-2-(3-thienyl)benzoyl]piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-[[5-methylsulfonyl-2-(3-thiophenyl)phenyl]-oxomethyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-(5-methylsulfonyl-2-thiophen-3-ylbenzoyl)piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-[5-mesyl-2-(3-thienyl)benzoyl]piperazino]phenyl]ethanone Formula: C24H24N2O4S2 MolecularWeight: 468.58836

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)S(=O)(=O)C)C4=CSC=C4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)S(=O)(=O)C)C4=CSC=C4

InChI

InChI=1S/C24H24N2O4S2/c1-17(27)18-3-5-20(6-4-18)25-10-12-26(13-11-25)24(28)23-15-21(32(2,29)30)7-8-22(23)19-9-14-31-16-19/h3-9,14-16H,10-13H2,1-2H3