N-[5-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]carbonyl-2-chloranyl-phenyl]-4-fluoranyl-benzenesulfonamide

Systemtic Name: N-[5-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]carbonyl-2-chloranyl-phenyl]-4-fluoranyl-benzenesulfonamide Openeye Name: N-[5-[4-(4-tert-butylphenyl)sulfonylpiperazine-1-carbonyl]-2-chloro-phenyl]-4-fluoro-benzenesulfonamide CAS Name: N-[5-[[4-(4-tert-butylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]-2-chlorophenyl]-4-fluorobenzenesulfonamide IUPAC Name: N-[5-[4-(4-tert-butylphenyl)sulfonylpiperazine-1-carbonyl]-2-chlorophenyl]-4-fluorobenzenesulfonamide Traditional Name: N-[5-[4-(4-tert-butylphenyl)sulfonylpiperazine-1-carbonyl]-2-chloro-phenyl]-4-fluoro-benzenesulfonamide Formula: C27H29ClFN3O5S2 MolecularWeight: 594.117663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)Cl)NS(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)Cl)NS(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C27H29ClFN3O5S2/c1-27(2,3)20-5-9-23(10-6-20)39(36,37)32-16-14-31(15-17-32)26(33)19-4-13-24(28)25(18-19)30-38(34,35)22-11-7-21(29)8-12-22/h4-13,18,30H,14-17H2,1-3H3