2-[2,4-bis(bromanyl)phenoxy]-N-[[(4-tert-butylphenyl)carbonylamino]carbamothioyl]ethanamide

Systemtic Name: 2-[2,4-bis(bromanyl)phenoxy]-N-[[(4-tert-butylphenyl)carbonylamino]carbamothioyl]ethanamide Openeye Name: N-[[(4-tert-butylbenzoyl)amino]carbamothioyl]-2-(2,4-dibromophenoxy)acetamide CAS Name: N-[[[(4-tert-butylphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-(2,4-dibromophenoxy)acetamide IUPAC Name: N-[[(4-tert-butylbenzoyl)amino]carbamothioyl]-2-(2,4-dibromophenoxy)acetamide Traditional Name: N-[[(4-tert-butylbenzoyl)amino]thiocarbamoyl]-2-(2,4-dibromophenoxy)acetamide Formula: C20H21Br2N3O3S MolecularWeight: 543.27204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)COC2=C(C=C(C=C2)Br)Br

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)COC2=C(C=C(C=C2)Br)Br

InChI

InChI=1S/C20H21Br2N3O3S/c1-20(2,3)13-6-4-12(5-7-13)18(27)24-25-19(29)23-17(26)11-28-16-9-8-14(21)10-15(16)22/h4-10H,11H2,1-3H3,(H,24,27)(H2,23,25,26,29)