2-[(3-fluorophenyl)methylsulfonyl-pentyl-amino]ethanethioamide

Systemtic Name: 2-[(3-fluorophenyl)methylsulfonyl-pentyl-amino]ethanethioamide Openeye Name: 2-[(3-fluorophenyl)methylsulfonyl-pentyl-amino]thioacetamide CAS Name: 2-[(3-fluorophenyl)methylsulfonyl-pentylamino]ethanethioamide IUPAC Name: 2-[(3-fluorophenyl)methylsulfonyl-pentylamino]ethanethioamide Traditional Name: 2-[amyl-(3-fluorobenzyl)sulfonyl-amino]thioacetamide Formula: C14H21FN2O2S2 MolecularWeight: 332.457143

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21FN2O2S2/c1-2-3-4-8-17(10-14(16)20)21(18,19)11-12-6-5-7-13(15)9-12/h5-7,9H,2-4,8,10-11H2,1H3,(H2,16,20)