2-[(3-fluorophenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]-N-phenethyl-ethanamide

Systemtic Name: 2-[(3-fluorophenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]-N-phenethyl-ethanamide Openeye Name: 2-(3-fluoro-N-(4-methylsulfanylphenyl)sulfonyl-anilino)-N-phenethyl-acetamide CAS Name: 2-(3-fluoro-N-[4-(methylthio)phenyl]sulfonylanilino)-N-phenethylacetamide IUPAC Name: 2-(3-fluoro-N-(4-methylsulfanylphenyl)sulfonylanilino)-N-phenethylacetamide Traditional Name: 2-(3-fluoro-N-[4-(methylthio)phenyl]sulfonyl-anilino)-N-phenethyl-acetamide Formula: C23H23FN2O3S2 MolecularWeight: 458.568723

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCCC2=CC=CC=C2)C3=CC(=CC=C3)F

Isomeric SMILES

CSC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCCC2=CC=CC=C2)C3=CC(=CC=C3)F

InChI

InChI=1S/C23H23FN2O3S2/c1-30-21-10-12-22(13-11-21)31(28,29)26(20-9-5-8-19(24)16-20)17-23(27)25-15-14-18-6-3-2-4-7-18/h2-13,16H,14-15,17H2,1H3,(H,25,27)