1-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-N-(3-methyl-1-phenyl-butyl)piperidine-4-carboxamide

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-N-(3-methyl-1-phenyl-butyl)piperidine-4-carboxamide Openeye Name: 1-(3-chloro-4-fluoro-phenyl)sulfonyl-N-(3-methyl-1-phenyl-butyl)piperidine-4-carboxamide CAS Name: 1-(3-chloro-4-fluorophenyl)sulfonyl-N-(3-methyl-1-phenylbutyl)-4-piperidinecarboxamide IUPAC Name: 1-(3-chloro-4-fluorophenyl)sulfonyl-N-(3-methyl-1-phenylbutyl)piperidine-4-carboxamide Traditional Name: 1-(3-chloro-4-fluoro-phenyl)sulfonyl-N-(3-methyl-1-phenyl-butyl)isonipecotamide Formula: C23H28ClFN2O3S MolecularWeight: 466.996423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC(C)CC(C1=CC=CC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C23H28ClFN2O3S/c1-16(2)14-22(17-6-4-3-5-7-17)26-23(28)18-10-12-27(13-11-18)31(29,30)19-8-9-21(25)20(24)15-19/h3-9,15-16,18,22H,10-14H2,1-2H3,(H,26,28)