N-(2,5-dimethylphenyl)-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-fluoranyl-benzamide

Systemtic Name: N-(2,5-dimethylphenyl)-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-fluoranyl-benzamide Openeye Name: N-(2,5-dimethylphenyl)-5-[(3,5-dimethyl-1-piperidyl)sulfonyl]-2-fluoro-benzamide CAS Name: N-(2,5-dimethylphenyl)-5-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-2-fluorobenzamide IUPAC Name: N-(2,5-dimethylphenyl)-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-fluorobenzamide Traditional Name: N-(2,5-dimethylphenyl)-5-(3,5-dimethylpiperidino)sulfonyl-2-fluoro-benzamide Formula: C22H27FN2O3S MolecularWeight: 418.524783

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C=C2)F)C(=O)NC3=C(C=CC(=C3)C)C)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C=C2)F)C(=O)NC3=C(C=CC(=C3)C)C)C

InChI

InChI=1S/C22H27FN2O3S/c1-14-5-6-17(4)21(10-14)24-22(26)19-11-18(7-8-20(19)23)29(27,28)25-12-15(2)9-16(3)13-25/h5-8,10-11,15-16H,9,12-13H2,1-4H3,(H,24,26)