N-[3-[(4-fluorophenyl)methylsulfanyl]propyl]-2-[(4-methylphenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-[3-[(4-fluorophenyl)methylsulfanyl]propyl]-2-[(4-methylphenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-[3-[(4-fluorophenyl)methylsulfanyl]propyl]-2-(4-methyl-N-methylsulfonyl-anilino)acetamide CAS Name: N-[3-[(4-fluorophenyl)methylthio]propyl]-2-(4-methyl-N-methylsulfonylanilino)acetamide IUPAC Name: N-[3-[(4-fluorophenyl)methylsulfanyl]propyl]-2-(4-methyl-N-methylsulfonylanilino)acetamide Traditional Name: N-[3-[(4-fluorobenzyl)thio]propyl]-2-(N-mesyl-4-methyl-anilino)acetamide Formula: C20H25FN2O3S2 MolecularWeight: 424.552503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CC(=O)NCCCSCC2=CC=C(C=C2)F)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N(CC(=O)NCCCSCC2=CC=C(C=C2)F)S(=O)(=O)C

InChI

InChI=1S/C20H25FN2O3S2/c1-16-4-10-19(11-5-16)23(28(2,25)26)14-20(24)22-12-3-13-27-15-17-6-8-18(21)9-7-17/h4-11H,3,12-15H2,1-2H3,(H,22,24)