N-(2-tert-butylsulfanylethyl)-2-[(4-fluorophenyl)sulfonyl-(4-methoxyphenyl)amino]ethanamide

Systemtic Name: N-(2-tert-butylsulfanylethyl)-2-[(4-fluorophenyl)sulfonyl-(4-methoxyphenyl)amino]ethanamide Openeye Name: N-(2-tert-butylsulfanylethyl)-2-(N-(4-fluorophenyl)sulfonyl-4-methoxy-anilino)acetamide CAS Name: N-[2-(tert-butylthio)ethyl]-2-(N-(4-fluorophenyl)sulfonyl-4-methoxyanilino)acetamide IUPAC Name: N-(2-tert-butylsulfanylethyl)-2-(N-(4-fluorophenyl)sulfonyl-4-methoxyanilino)acetamide Traditional Name: N-[2-(tert-butylthio)ethyl]-2-(N-(4-fluorophenyl)sulfonyl-4-methoxy-anilino)acetamide Formula: C21H27FN2O4S2 MolecularWeight: 454.578483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCCNC(=O)CN(C1=CC=C(C=C1)OC)S(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)(C)SCCNC(=O)CN(C1=CC=C(C=C1)OC)S(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C21H27FN2O4S2/c1-21(2,3)29-14-13-23-20(25)15-24(17-7-9-18(28-4)10-8-17)30(26,27)19-11-5-16(22)6-12-19/h5-12H,13-15H2,1-4H3,(H,23,25)