4-[3-[4-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperazin-1-yl]-3-oxidanylidene-propyl]benzenesulfonamide

Systemtic Name: 4-[3-[4-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperazin-1-yl]-3-oxidanylidene-propyl]benzenesulfonamide Openeye Name: 4-[3-[4-(5-chloro-2-fluoro-benzoyl)piperazin-1-yl]-3-oxo-propyl]benzenesulfonamide CAS Name: 4-[3-[4-[(5-chloro-2-fluorophenyl)-oxomethyl]-1-piperazinyl]-3-oxopropyl]benzenesulfonamide IUPAC Name: 4-[3-[4-(5-chloro-2-fluorobenzoyl)piperazin-1-yl]-3-oxopropyl]benzenesulfonamide Traditional Name: 4-[3-[4-(5-chloro-2-fluoro-benzoyl)piperazino]-3-keto-propyl]benzenesulfonamide Formula: C20H21ClFN3O4S MolecularWeight: 453.914843

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC2=CC=C(C=C2)S(=O)(=O)N)C(=O)C3=C(C=CC(=C3)Cl)F

Isomeric SMILES

C1CN(CCN1C(=O)CCC2=CC=C(C=C2)S(=O)(=O)N)C(=O)C3=C(C=CC(=C3)Cl)F

InChI

InChI=1S/C20H21ClFN3O4S/c21-15-4-7-18(22)17(13-15)20(27)25-11-9-24(10-12-25)19(26)8-3-14-1-5-16(6-2-14)30(23,28)29/h1-2,4-7,13H,3,8-12H2,(H2,23,28,29)