N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2-[(4-methylphenyl)-methylsulfonyl-amino]propanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C(C)C(=O)NCCSCC2=CC=CC=C2F)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N(C(C)C(=O)NCCSCC2=CC=CC=C2F)S(=O)(=O)C

InChI

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