N-[1-[2-fluoranyl-4-(2-methylsulfonylphenyl)phenyl]-2-oxidanylidene-piperidin-3-yl]-3-oxidanyl-propanamide

Systemtic Name: N-[1-[2-fluoranyl-4-(2-methylsulfonylphenyl)phenyl]-2-oxidanylidene-piperidin-3-yl]-3-oxidanyl-propanamide Openeye Name: N-[1-[2-fluoro-4-(2-methylsulfonylphenyl)phenyl]-2-oxo-3-piperidyl]-3-hydroxy-propanamide CAS Name: N-[1-[2-fluoro-4-(2-methylsulfonylphenyl)phenyl]-2-oxo-3-piperidinyl]-3-hydroxypropanamide IUPAC Name: N-[1-[2-fluoro-4-(2-methylsulfonylphenyl)phenyl]-2-oxopiperidin-3-yl]-3-hydroxypropanamide Traditional Name: N-[1-[2-fluoro-4-(2-mesylphenyl)phenyl]-2-keto-3-piperidyl]-3-hydroxy-propionamide Formula: C21H23FN2O5S MolecularWeight: 434.481123

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C2=CC(=C(C=C2)N3CCCC(C3=O)NC(=O)CCO)F

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C2=CC(=C(C=C2)N3CCCC(C3=O)NC(=O)CCO)F

InChI

InChI=1S/C21H23FN2O5S/c1-30(28,29)19-7-3-2-5-15(19)14-8-9-18(16(22)13-14)24-11-4-6-17(21(24)27)23-20(26)10-12-25/h2-3,5,7-9,13,17,25H,4,6,10-12H2,1H3,(H,23,26)