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

Systemtic Name: 1-[4-(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylpiperazin-1-yl]-2-morpholin-4-yl-ethanone Openeye Name: 1-[4-(2-chloro-5-pyrrolidin-1-ylsulfonyl-benzoyl)piperazin-1-yl]-2-morpholino-ethanone CAS Name: 1-[4-[[2-chloro-5-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]-1-piperazinyl]-2-(4-morpholinyl)ethanone IUPAC Name: 1-[4-(2-chloro-5-pyrrolidin-1-ylsulfonylbenzoyl)piperazin-1-yl]-2-morpholin-4-ylethanone Traditional Name: 1-[4-(2-chloro-5-pyrrolidinosulfonyl-benzoyl)piperazino]-2-morpholino-ethanone Formula: C21H29ClN4O5S MolecularWeight: 484.99676

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)N3CCN(CC3)C(=O)CN4CCOCC4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)N3CCN(CC3)C(=O)CN4CCOCC4

InChI

InChI=1S/C21H29ClN4O5S/c22-19-4-3-17(32(29,30)26-5-1-2-6-26)15-18(19)21(28)25-9-7-24(8-10-25)20(27)16-23-11-13-31-14-12-23/h3-4,15H,1-2,5-14,16H2