N-[3-[(2-fluorophenyl)methylsulfanyl]propyl]-2-[(3-methoxyphenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-[3-[(2-fluorophenyl)methylsulfanyl]propyl]-2-[(3-methoxyphenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-[3-[(2-fluorophenyl)methylsulfanyl]propyl]-2-(3-methoxy-N-methylsulfonyl-anilino)acetamide CAS Name: N-[3-[(2-fluorophenyl)methylthio]propyl]-2-(3-methoxy-N-methylsulfonylanilino)acetamide IUPAC Name: N-[3-[(2-fluorophenyl)methylsulfanyl]propyl]-2-(3-methoxy-N-methylsulfonylanilino)acetamide Traditional Name: N-[3-[(2-fluorobenzyl)thio]propyl]-2-(N-mesyl-3-methoxy-anilino)acetamide Formula: C20H25FN2O4S2 MolecularWeight: 440.551903

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N(CC(=O)NCCCSCC2=CC=CC=C2F)S(=O)(=O)C

Isomeric SMILES

COC1=CC=CC(=C1)N(CC(=O)NCCCSCC2=CC=CC=C2F)S(=O)(=O)C

InChI

InChI=1S/C20H25FN2O4S2/c1-27-18-9-5-8-17(13-18)23(29(2,25)26)14-20(24)22-11-6-12-28-15-16-7-3-4-10-19(16)21/h3-5,7-10,13H,6,11-12,14-15H2,1-2H3,(H,22,24)