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

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methyl-(4-methylphenyl)sulfonyl-amino]-N-(3-oxidanylpropyl)ethanamide Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methyl-(p-tolylsulfonyl)amino]-N-(3-hydroxypropyl)acetamide CAS Name: 2-[(2-chloro-6-fluorophenyl)methyl-(4-methylphenyl)sulfonylamino]-N-(3-hydroxypropyl)acetamide IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methyl-(4-methylphenyl)sulfonylamino]-N-(3-hydroxypropyl)acetamide Traditional Name: 2-[(2-chloro-6-fluoro-benzyl)-tosyl-amino]-N-(3-hydroxypropyl)acetamide Formula: C19H22ClFN2O4S MolecularWeight: 428.905383

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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)NCCCO

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=C(C=CC=C2Cl)F)CC(=O)NCCCO

InChI

InChI=1S/C19H22ClFN2O4S/c1-14-6-8-15(9-7-14)28(26,27)23(13-19(25)22-10-3-11-24)12-16-17(20)4-2-5-18(16)21/h2,4-9,24H,3,10-13H2,1H3,(H,22,25)