N-[2-chloranyl-5-(4-ethylpiperazin-1-yl)-3-(2-methylphenyl)phenyl]-4-fluoranyl-benzenesulfonamide

Systemtic Name: N-[2-chloranyl-5-(4-ethylpiperazin-1-yl)-3-(2-methylphenyl)phenyl]-4-fluoranyl-benzenesulfonamide Openeye Name: N-[2-chloro-5-(4-ethylpiperazin-1-yl)-3-(o-tolyl)phenyl]-4-fluoro-benzenesulfonamide CAS Name: N-[2-chloro-5-(4-ethyl-1-piperazinyl)-3-(2-methylphenyl)phenyl]-4-fluorobenzenesulfonamide IUPAC Name: N-[2-chloro-5-(4-ethylpiperazin-1-yl)-3-(2-methylphenyl)phenyl]-4-fluorobenzenesulfonamide Traditional Name: N-[2-chloro-5-(4-ethylpiperazino)-3-(o-tolyl)phenyl]-4-fluoro-benzenesulfonamide Formula: C25H27ClFN3O2S MolecularWeight: 488.017183

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC(=C(C(=C2)C3=CC=CC=C3C)Cl)NS(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CCN1CCN(CC1)C2=CC(=C(C(=C2)C3=CC=CC=C3C)Cl)NS(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H27ClFN3O2S/c1-3-29-12-14-30(15-13-29)20-16-23(22-7-5-4-6-18(22)2)25(26)24(17-20)28-33(31,32)21-10-8-19(27)9-11-21/h4-11,16-17,28H,3,12-15H2,1-2H3