N-[2-chloranyl-5-[4-(thiophen-3-ylmethyl)piperazin-1-yl]carbonyl-phenyl]-4-fluoranyl-benzenesulfonamide

Systemtic Name: N-[2-chloranyl-5-[4-(thiophen-3-ylmethyl)piperazin-1-yl]carbonyl-phenyl]-4-fluoranyl-benzenesulfonamide Openeye Name: N-[2-chloro-5-[4-(3-thienylmethyl)piperazine-1-carbonyl]phenyl]-4-fluoro-benzenesulfonamide CAS Name: N-[2-chloro-5-[oxo-[4-(3-thiophenylmethyl)-1-piperazinyl]methyl]phenyl]-4-fluorobenzenesulfonamide IUPAC Name: N-[2-chloro-5-[4-(thiophen-3-ylmethyl)piperazine-1-carbonyl]phenyl]-4-fluorobenzenesulfonamide Traditional Name: N-[2-chloro-5-[4-(3-thenyl)piperazine-1-carbonyl]phenyl]-4-fluoro-benzenesulfonamide Formula: C22H21ClFN3O3S2 MolecularWeight: 494.001843

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CSC=C2)C(=O)C3=CC(=C(C=C3)Cl)NS(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1CC2=CSC=C2)C(=O)C3=CC(=C(C=C3)Cl)NS(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H21ClFN3O3S2/c23-20-6-1-17(13-21(20)25-32(29,30)19-4-2-18(24)3-5-19)22(28)27-10-8-26(9-11-27)14-16-7-12-31-15-16/h1-7,12-13,15,25H,8-11,14H2