2-[(2-bromanyl-4-fluoranyl-phenyl)carbamothioyl-ethyl-amino]-N-(2,6-dimethylphenyl)ethanamide

Systemtic Name: 2-[(2-bromanyl-4-fluoranyl-phenyl)carbamothioyl-ethyl-amino]-N-(2,6-dimethylphenyl)ethanamide Openeye Name: 2-[(2-bromo-4-fluoro-phenyl)carbamothioyl-ethyl-amino]-N-(2,6-dimethylphenyl)acetamide CAS Name: 2-[[(2-bromo-4-fluoroanilino)-sulfanylidenemethyl]-ethylamino]-N-(2,6-dimethylphenyl)acetamide IUPAC Name: 2-[(2-bromo-4-fluorophenyl)carbamothioyl-ethylamino]-N-(2,6-dimethylphenyl)acetamide Traditional Name: 2-[(2-bromo-4-fluoro-phenyl)thiocarbamoyl-ethyl-amino]-N-(2,6-dimethylphenyl)acetamide Formula: C19H21BrFN3OS MolecularWeight: 438.356943

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1=C(C=CC=C1C)C)C(=S)NC2=C(C=C(C=C2)F)Br

Isomeric SMILES

CCN(CC(=O)NC1=C(C=CC=C1C)C)C(=S)NC2=C(C=C(C=C2)F)Br

InChI

InChI=1S/C19H21BrFN3OS/c1-4-24(19(26)22-16-9-8-14(21)10-15(16)20)11-17(25)23-18-12(2)6-5-7-13(18)3/h5-10H,4,11H2,1-3H3,(H,22,26)(H,23,25)