1-[4-[4-(3-methylsulfonylphenyl)carbonylpiperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-(3-methylsulfonylphenyl)carbonylpiperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-(3-methylsulfonylbenzoyl)piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-[(3-methylsulfonylphenyl)-oxomethyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-(3-methylsulfonylbenzoyl)piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-(3-mesylbenzoyl)piperazino]phenyl]ethanone Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O4S/c1-15(23)16-6-8-18(9-7-16)21-10-12-22(13-11-21)20(24)17-4-3-5-19(14-17)27(2,25)26/h3-9,14H,10-13H2,1-2H3