2-[(3-bromophenyl)-(4-methylphenyl)sulfonyl-amino]-N-[(4-fluorophenyl)methyl]ethanamide

Systemtic Name: 2-[(3-bromophenyl)-(4-methylphenyl)sulfonyl-amino]-N-[(4-fluorophenyl)methyl]ethanamide Openeye Name: 2-[3-bromo-N-(p-tolylsulfonyl)anilino]-N-[(4-fluorophenyl)methyl]acetamide CAS Name: 2-(3-bromo-N-(4-methylphenyl)sulfonylanilino)-N-[(4-fluorophenyl)methyl]acetamide IUPAC Name: 2-(3-bromo-N-(4-methylphenyl)sulfonylanilino)-N-[(4-fluorophenyl)methyl]acetamide Traditional Name: 2-(3-bromo-N-tosyl-anilino)-N-(4-fluorobenzyl)acetamide Formula: C22H20BrFN2O3S MolecularWeight: 491.373203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCC2=CC=C(C=C2)F)C3=CC(=CC=C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCC2=CC=C(C=C2)F)C3=CC(=CC=C3)Br

InChI

InChI=1S/C22H20BrFN2O3S/c1-16-5-11-21(12-6-16)30(28,29)26(20-4-2-3-18(23)13-20)15-22(27)25-14-17-7-9-19(24)10-8-17/h2-13H,14-15H2,1H3,(H,25,27)