2-[4-(2-methyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylpiperazin-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-(2-methyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylpiperazin-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-(2-methyl-5-pyrrolidin-1-ylsulfonyl-benzoyl)piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[[2-methyl-5-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]-1-piperazinyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-(2-methyl-5-pyrrolidin-1-ylsulfonylbenzoyl)piperazin-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-(2-methyl-5-pyrrolidinosulfonyl-benzoyl)piperazino]-1-pyrrolidino-ethanone Formula: C22H32N4O4S MolecularWeight: 448.57888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)N3CCN(CC3)CC(=O)N4CCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)N3CCN(CC3)CC(=O)N4CCCC4

InChI

InChI=1S/C22H32N4O4S/c1-18-6-7-19(31(29,30)26-10-4-5-11-26)16-20(18)22(28)25-14-12-23(13-15-25)17-21(27)24-8-2-3-9-24/h6-7,16H,2-5,8-15,17H2,1H3