N-(2,4-dimethylpentan-3-yl)-1-[(2-fluorophenyl)methylsulfonyl]piperidine-4-carboxamide

Systemtic Name: N-(2,4-dimethylpentan-3-yl)-1-[(2-fluorophenyl)methylsulfonyl]piperidine-4-carboxamide Openeye Name: 1-[(2-fluorophenyl)methylsulfonyl]-N-(1-isopropyl-2-methyl-propyl)piperidine-4-carboxamide CAS Name: N-(2,4-dimethylpentan-3-yl)-1-[(2-fluorophenyl)methylsulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(2,4-dimethylpentan-3-yl)-1-[(2-fluorophenyl)methylsulfonyl]piperidine-4-carboxamide Traditional Name: 1-(2-fluorobenzyl)sulfonyl-N-(1-isopropyl-2-methyl-propyl)isonipecotamide Formula: C20H31FN2O3S MolecularWeight: 398.535143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C)C)NC(=O)C1CCN(CC1)S(=O)(=O)CC2=CC=CC=C2F

Isomeric SMILES

CC(C)C(C(C)C)NC(=O)C1CCN(CC1)S(=O)(=O)CC2=CC=CC=C2F

InChI

InChI=1S/C20H31FN2O3S/c1-14(2)19(15(3)4)22-20(24)16-9-11-23(12-10-16)27(25,26)13-17-7-5-6-8-18(17)21/h5-8,14-16,19H,9-13H2,1-4H3,(H,22,24)