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

Systemtic Name: 1-[4-[4-(3-pyrrolidin-1-ylsulfonylphenyl)carbonylpiperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-(3-pyrrolidin-1-ylsulfonylbenzoyl)piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-[oxo-[3-(1-pyrrolidinylsulfonyl)phenyl]methyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-(3-pyrrolidin-1-ylsulfonylbenzoyl)piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-(3-pyrrolidinosulfonylbenzoyl)piperazino]phenyl]ethanone Formula: C23H27N3O4S MolecularWeight: 441.54318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C23H27N3O4S/c1-18(27)19-7-9-21(10-8-19)24-13-15-25(16-14-24)23(28)20-5-4-6-22(17-20)31(29,30)26-11-2-3-12-26/h4-10,17H,2-3,11-16H2,1H3