3-[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]carbonyl-4-methyl-benzenesulfonamide

Systemtic Name: 3-[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]carbonyl-4-methyl-benzenesulfonamide Openeye Name: 3-[4-[(2-chloro-6-fluoro-phenyl)methyl]piperazine-1-carbonyl]-4-methyl-benzenesulfonamide CAS Name: 3-[[4-[(2-chloro-6-fluorophenyl)methyl]-1-piperazinyl]-oxomethyl]-4-methylbenzenesulfonamide IUPAC Name: 3-[4-[(2-chloro-6-fluorophenyl)methyl]piperazine-1-carbonyl]-4-methylbenzenesulfonamide Traditional Name: 3-[4-(2-chloro-6-fluoro-benzyl)piperazine-1-carbonyl]-4-methyl-benzenesulfonamide Formula: C19H21ClFN3O3S MolecularWeight: 425.904743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)N2CCN(CC2)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)N2CCN(CC2)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C19H21ClFN3O3S/c1-13-5-6-14(28(22,26)27)11-15(13)19(25)24-9-7-23(8-10-24)12-16-17(20)3-2-4-18(16)21/h2-6,11H,7-10,12H2,1H3,(H2,22,26,27)