N-[3-[(4-fluorophenyl)methylsulfanyl]propyl]-2-[(4-methoxy-3-methyl-phenyl)sulfonyl-phenyl-amino]ethanamide

Systemtic Name: N-[3-[(4-fluorophenyl)methylsulfanyl]propyl]-2-[(4-methoxy-3-methyl-phenyl)sulfonyl-phenyl-amino]ethanamide Openeye Name: N-[3-[(4-fluorophenyl)methylsulfanyl]propyl]-2-(N-(4-methoxy-3-methyl-phenyl)sulfonylanilino)acetamide CAS Name: N-[3-[(4-fluorophenyl)methylthio]propyl]-2-(N-(4-methoxy-3-methylphenyl)sulfonylanilino)acetamide IUPAC Name: N-[3-[(4-fluorophenyl)methylsulfanyl]propyl]-2-(N-(4-methoxy-3-methylphenyl)sulfonylanilino)acetamide Traditional Name: N-[3-[(4-fluorobenzyl)thio]propyl]-2-(N-(4-methoxy-3-methyl-phenyl)sulfonylanilino)acetamide Formula: C26H29FN2O4S2 MolecularWeight: 516.647863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N(CC(=O)NCCCSCC2=CC=C(C=C2)F)C3=CC=CC=C3)OC

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N(CC(=O)NCCCSCC2=CC=C(C=C2)F)C3=CC=CC=C3)OC

InChI

InChI=1S/C26H29FN2O4S2/c1-20-17-24(13-14-25(20)33-2)35(31,32)29(23-7-4-3-5-8-23)18-26(30)28-15-6-16-34-19-21-9-11-22(27)12-10-21/h3-5,7-14,17H,6,15-16,18-19H2,1-2H3,(H,28,30)