(2R)-N-(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)-2-(2-fluorophenyl)sulfanyl-propanamide

Systemtic Name: (2R)-N-(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)-2-(2-fluorophenyl)sulfanyl-propanamide Openeye Name: (2R)-N-[2-chloro-5-(1-piperidylsulfonyl)phenyl]-2-(2-fluorophenyl)sulfanyl-propanamide CAS Name: (2R)-N-[2-chloro-5-(1-piperidinylsulfonyl)phenyl]-2-[(2-fluorophenyl)thio]propanamide IUPAC Name: (2R)-N-(2-chloro-5-piperidin-1-ylsulfonylphenyl)-2-(2-fluorophenyl)sulfanylpropanamide Traditional Name: (2R)-N-(2-chloro-5-piperidinosulfonyl-phenyl)-2-[(2-fluorophenyl)thio]propionamide Formula: C20H22ClFN2O3S2 MolecularWeight: 456.981683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCCCC2)Cl)SC3=CC=CC=C3F

Isomeric SMILES

C[C@H](C(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCCCC2)Cl)SC3=CC=CC=C3F

InChI

InChI=1S/C20H22ClFN2O3S2/c1-14(28-19-8-4-3-7-17(19)22)20(25)23-18-13-15(9-10-16(18)21)29(26,27)24-11-5-2-6-12-24/h3-4,7-10,13-14H,2,5-6,11-12H2,1H3,(H,23,25)/t14-/m1/s1