2-chloranyl-N-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]ethyl]-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]ethyl]-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]ethyl]-5-(1-piperidylsulfonyl)benzamide CAS Name: 2-chloro-N-[2-[(2-chloro-6-fluorophenyl)methylthio]ethyl]-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]-5-piperidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[2-[(2-chloro-6-fluoro-benzyl)thio]ethyl]-5-piperidinosulfonyl-benzamide Formula: C21H23Cl2FN2O3S2 MolecularWeight: 505.453323

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCCSCC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCCSCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C21H23Cl2FN2O3S2/c22-18-5-4-6-20(24)17(18)14-30-12-9-25-21(27)16-13-15(7-8-19(16)23)31(28,29)26-10-2-1-3-11-26/h4-8,13H,1-3,9-12,14H2,(H,25,27)