2-[(3-chloranyl-2-fluoranyl-phenyl)methylsulfonyl-pentyl-amino]ethanethioamide

Systemtic Name: 2-[(3-chloranyl-2-fluoranyl-phenyl)methylsulfonyl-pentyl-amino]ethanethioamide Openeye Name: 2-[(3-chloro-2-fluoro-phenyl)methylsulfonyl-pentyl-amino]thioacetamide CAS Name: 2-[(3-chloro-2-fluorophenyl)methylsulfonyl-pentylamino]ethanethioamide IUPAC Name: 2-[(3-chloro-2-fluorophenyl)methylsulfonyl-pentylamino]ethanethioamide Traditional Name: 2-[amyl-(3-chloro-2-fluoro-benzyl)sulfonyl-amino]thioacetamide Formula: C14H20ClFN2O2S2 MolecularWeight: 366.902203

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC(=S)N)S(=O)(=O)CC1=C(C(=CC=C1)Cl)F

Isomeric SMILES

CCCCCN(CC(=S)N)S(=O)(=O)CC1=C(C(=CC=C1)Cl)F

InChI

InChI=1S/C14H20ClFN2O2S2/c1-2-3-4-8-18(9-13(17)21)22(19,20)10-11-6-5-7-12(15)14(11)16/h5-7H,2-4,8-10H2,1H3,(H2,17,21)