2-chloranyl-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-5-(1-piperidylsulfonyl)benzamide CAS Name: 2-chloro-N-[2-[(2-fluorophenyl)methylthio]ethyl]-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-5-piperidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[2-[(2-fluorobenzyl)thio]ethyl]-5-piperidinosulfonyl-benzamide Formula: C21H24ClFN2O3S2 MolecularWeight: 471.008263

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCCSCC3=CC=CC=C3F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCCSCC3=CC=CC=C3F

InChI

InChI=1S/C21H24ClFN2O3S2/c22-19-9-8-17(30(27,28)25-11-4-1-5-12-25)14-18(19)21(26)24-10-13-29-15-16-6-2-3-7-20(16)23/h2-3,6-9,14H,1,4-5,10-13,15H2,(H,24,26)