2-[(4-tert-butylphenyl)-methylsulfonyl-amino]-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]ethanamide

Systemtic Name: 2-[(4-tert-butylphenyl)-methylsulfonyl-amino]-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]ethanamide Openeye Name: 2-(4-tert-butyl-N-methylsulfonyl-anilino)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]acetamide CAS Name: 2-(4-tert-butyl-N-methylsulfonylanilino)-N-[2-[(2-fluorophenyl)methylthio]ethyl]acetamide IUPAC Name: 2-(4-tert-butyl-N-methylsulfonylanilino)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]acetamide Traditional Name: 2-(4-tert-butyl-N-mesyl-anilino)-N-[2-[(2-fluorobenzyl)thio]ethyl]acetamide Formula: C22H29FN2O3S2 MolecularWeight: 452.605663

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29FN2O3S2/c1-22(2,3)18-9-11-19(12-10-18)25(30(4,27)28)15-21(26)24-13-14-29-16-17-7-5-6-8-20(17)23/h5-12H,13-16H2,1-4H3,(H,24,26)