2-[(2-chloranyl-6-fluoranyl-phenyl)methyl-(4-methylphenyl)sulfonyl-amino]-N-(3-methylsulfanylphenyl)ethanamide

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methyl-(4-methylphenyl)sulfonyl-amino]-N-(3-methylsulfanylphenyl)ethanamide Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methyl-(p-tolylsulfonyl)amino]-N-(3-methylsulfanylphenyl)acetamide CAS Name: 2-[(2-chloro-6-fluorophenyl)methyl-(4-methylphenyl)sulfonylamino]-N-[3-(methylthio)phenyl]acetamide IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methyl-(4-methylphenyl)sulfonylamino]-N-(3-methylsulfanylphenyl)acetamide Traditional Name: 2-[(2-chloro-6-fluoro-benzyl)-tosyl-amino]-N-[3-(methylthio)phenyl]acetamide Formula: C23H22ClFN2O3S2 MolecularWeight: 493.013783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=C(C=CC=C2Cl)F)CC(=O)NC3=CC(=CC=C3)SC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=C(C=CC=C2Cl)F)CC(=O)NC3=CC(=CC=C3)SC

InChI

InChI=1S/C23H22ClFN2O3S2/c1-16-9-11-19(12-10-16)32(29,30)27(14-20-21(24)7-4-8-22(20)25)15-23(28)26-17-5-3-6-18(13-17)31-2/h3-13H,14-15H2,1-2H3,(H,26,28)