2-[(4-bromanyl-3-methyl-phenyl)carbamothioyl-ethyl-amino]-N-(2,6-dimethylphenyl)ethanamide

Systemtic Name: 2-[(4-bromanyl-3-methyl-phenyl)carbamothioyl-ethyl-amino]-N-(2,6-dimethylphenyl)ethanamide Openeye Name: 2-[(4-bromo-3-methyl-phenyl)carbamothioyl-ethyl-amino]-N-(2,6-dimethylphenyl)acetamide CAS Name: 2-[[(4-bromo-3-methylanilino)-sulfanylidenemethyl]-ethylamino]-N-(2,6-dimethylphenyl)acetamide IUPAC Name: 2-[(4-bromo-3-methylphenyl)carbamothioyl-ethylamino]-N-(2,6-dimethylphenyl)acetamide Traditional Name: 2-[(4-bromo-3-methyl-phenyl)thiocarbamoyl-ethyl-amino]-N-(2,6-dimethylphenyl)acetamide Formula: C20H24BrN3OS MolecularWeight: 434.39306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24BrN3OS/c1-5-24(20(26)22-16-9-10-17(21)15(4)11-16)12-18(25)23-19-13(2)7-6-8-14(19)3/h6-11H,5,12H2,1-4H3,(H,22,26)(H,23,25)