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

Systemtic Name: 3-[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]carbonyl-N-propan-2-yl-benzenesulfonamide Openeye Name: 3-[4-[(2-chloro-6-fluoro-phenyl)methyl]piperazine-1-carbonyl]-N-isopropyl-benzenesulfonamide CAS Name: 3-[[4-[(2-chloro-6-fluorophenyl)methyl]-1-piperazinyl]-oxomethyl]-N-propan-2-ylbenzenesulfonamide IUPAC Name: 3-[4-[(2-chloro-6-fluorophenyl)methyl]piperazine-1-carbonyl]-N-propan-2-ylbenzenesulfonamide Traditional Name: 3-[4-(2-chloro-6-fluoro-benzyl)piperazine-1-carbonyl]-N-isopropyl-benzenesulfonamide Formula: C21H25ClFN3O3S MolecularWeight: 453.957903

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCN(CC2)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCN(CC2)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C21H25ClFN3O3S/c1-15(2)24-30(28,29)17-6-3-5-16(13-17)21(27)26-11-9-25(10-12-26)14-18-19(22)7-4-8-20(18)23/h3-8,13,15,24H,9-12,14H2,1-2H3