N-[2-(4-fluoranylphenoxy)ethyl]-N-methyl-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-butanamide

Systemtic Name: N-[2-(4-fluoranylphenoxy)ethyl]-N-methyl-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-butanamide Openeye Name: N-[2-(4-fluorophenoxy)ethyl]-N-methyl-4-methylsulfanyl-2-(p-tolylsulfonylamino)butanamide CAS Name: N-[2-(4-fluorophenoxy)ethyl]-N-methyl-2-[(4-methylphenyl)sulfonylamino]-4-(methylthio)butanamide IUPAC Name: N-[2-(4-fluorophenoxy)ethyl]-N-methyl-2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanylbutanamide Traditional Name: N-[2-(4-fluorophenoxy)ethyl]-N-methyl-4-(methylthio)-2-(tosylamino)butyramide Formula: C21H27FN2O4S2 MolecularWeight: 454.578483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)N(C)CCOC2=CC=C(C=C2)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)N(C)CCOC2=CC=C(C=C2)F

InChI

InChI=1S/C21H27FN2O4S2/c1-16-4-10-19(11-5-16)30(26,27)23-20(12-15-29-3)21(25)24(2)13-14-28-18-8-6-17(22)7-9-18/h4-11,20,23H,12-15H2,1-3H3