N-[2-(3,4-dimethoxyphenyl)ethyl]-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-fluoranyl-benzamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-fluoranyl-benzamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(3,5-dimethyl-1-piperidyl)sulfonyl]-2-fluoro-benzamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-2-fluorobenzamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-fluorobenzamide Traditional Name: 5-(3,5-dimethylpiperidino)sulfonyl-2-fluoro-N-homoveratryl-benzamide Formula: C24H31FN2O5S MolecularWeight: 478.576743

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C=C2)F)C(=O)NCCC3=CC(=C(C=C3)OC)OC)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C=C2)F)C(=O)NCCC3=CC(=C(C=C3)OC)OC)C

InChI

InChI=1S/C24H31FN2O5S/c1-16-11-17(2)15-27(14-16)33(29,30)19-6-7-21(25)20(13-19)24(28)26-10-9-18-5-8-22(31-3)23(12-18)32-4/h5-8,12-13,16-17H,9-11,14-15H2,1-4H3,(H,26,28)