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

Systemtic Name: 2-chloranyl-N-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]ethyl]-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]ethyl]-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 2-chloro-N-[2-[(2-chloro-6-fluorophenyl)methylthio]ethyl]-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[2-[(2-chloro-6-fluoro-benzyl)thio]ethyl]-5-pyrrolidinosulfonyl-benzamide Formula: C20H21Cl2FN2O3S2 MolecularWeight: 491.426743

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCCSCC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCCSCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C20H21Cl2FN2O3S2/c21-17-4-3-5-19(23)16(17)13-29-11-8-24-20(26)15-12-14(6-7-18(15)22)30(27,28)25-9-1-2-10-25/h3-7,12H,1-2,8-11,13H2,(H,24,26)