1-[4-(4-ethanoylphenyl)sulfonylpiperazin-1-yl]-4-phenyl-butan-1-one

Systemtic Name: 1-[4-(4-ethanoylphenyl)sulfonylpiperazin-1-yl]-4-phenyl-butan-1-one Openeye Name: 1-[4-(4-acetylphenyl)sulfonylpiperazin-1-yl]-4-phenyl-butan-1-one CAS Name: 1-[4-(4-acetylphenyl)sulfonyl-1-piperazinyl]-4-phenyl-1-butanone IUPAC Name: 1-[4-(4-acetylphenyl)sulfonylpiperazin-1-yl]-4-phenylbutan-1-one Traditional Name: 1-[4-(4-acetylphenyl)sulfonylpiperazino]-4-phenyl-butan-1-one Formula: C22H26N2O4S MolecularWeight: 414.51784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCCC3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCCC3=CC=CC=C3

InChI

InChI=1S/C22H26N2O4S/c1-18(25)20-10-12-21(13-11-20)29(27,28)24-16-14-23(15-17-24)22(26)9-5-8-19-6-3-2-4-7-19/h2-4,6-7,10-13H,5,8-9,14-17H2,1H3