1-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfonyl]-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfonyl]-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide Openeye Name: 1-[(2-chloro-6-fluoro-phenyl)methylsulfonyl]-N-(m-tolylmethyl)piperidine-4-carboxamide CAS Name: 1-[(2-chloro-6-fluorophenyl)methylsulfonyl]-N-[(3-methylphenyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-[(2-chloro-6-fluorophenyl)methylsulfonyl]-N-[(3-methylphenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-(2-chloro-6-fluoro-benzyl)sulfonyl-N-(3-methylbenzyl)isonipecotamide Formula: C21H24ClFN2O3S MolecularWeight: 438.943263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CC1=CC(=CC=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C21H24ClFN2O3S/c1-15-4-2-5-16(12-15)13-24-21(26)17-8-10-25(11-9-17)29(27,28)14-18-19(22)6-3-7-20(18)23/h2-7,12,17H,8-11,13-14H2,1H3,(H,24,26)