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

Systemtic Name: 1-[4-[4-(2-phenethylphenyl)carbonylpiperazin-1-yl]sulfonylphenyl]ethanone Openeye Name: 1-[4-[4-(2-phenethylbenzoyl)piperazin-1-yl]sulfonylphenyl]ethanone CAS Name: 1-[4-[[4-[oxo-(2-phenethylphenyl)methyl]-1-piperazinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[4-[4-(2-phenethylbenzoyl)piperazin-1-yl]sulfonylphenyl]ethanone Traditional Name: 1-[4-[4-(2-phenethylbenzoyl)piperazino]sulfonylphenyl]ethanone Formula: C27H28N2O4S MolecularWeight: 476.58722

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3CCC4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3CCC4=CC=CC=C4

InChI

InChI=1S/C27H28N2O4S/c1-21(30)23-13-15-25(16-14-23)34(32,33)29-19-17-28(18-20-29)27(31)26-10-6-5-9-24(26)12-11-22-7-3-2-4-8-22/h2-10,13-16H,11-12,17-20H2,1H3