N-[[3,5-bis(bromanyl)-4-oxidanyl-phenyl]carbamothioyl]-2-(4-tert-butylphenoxy)ethanamide

Systemtic Name: N-[[3,5-bis(bromanyl)-4-oxidanyl-phenyl]carbamothioyl]-2-(4-tert-butylphenoxy)ethanamide Openeye Name: 2-(4-tert-butylphenoxy)-N-[(3,5-dibromo-4-hydroxy-phenyl)carbamothioyl]acetamide CAS Name: 2-(4-tert-butylphenoxy)-N-[(3,5-dibromo-4-hydroxyanilino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-tert-butylphenoxy)-N-[(3,5-dibromo-4-hydroxyphenyl)carbamothioyl]acetamide Traditional Name: 2-(4-tert-butylphenoxy)-N-[(3,5-dibromo-4-hydroxy-phenyl)thiocarbamoyl]acetamide Formula: C19H20Br2N2O3S MolecularWeight: 516.2467

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC(=O)NC(=S)NC2=CC(=C(C(=C2)Br)O)Br

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC(=O)NC(=S)NC2=CC(=C(C(=C2)Br)O)Br

InChI

InChI=1S/C19H20Br2N2O3S/c1-19(2,3)11-4-6-13(7-5-11)26-10-16(24)23-18(27)22-12-8-14(20)17(25)15(21)9-12/h4-9,25H,10H2,1-3H3,(H2,22,23,24,27)