5-bromanyl-N-[[2-(2-bromanyl-4-tert-butyl-phenoxy)ethanoylamino]carbamothioyl]-2-methoxy-benzamide

Systemtic Name: 5-bromanyl-N-[[2-(2-bromanyl-4-tert-butyl-phenoxy)ethanoylamino]carbamothioyl]-2-methoxy-benzamide Openeye Name: 5-bromo-N-[[[2-(2-bromo-4-tert-butyl-phenoxy)acetyl]amino]carbamothioyl]-2-methoxy-benzamide CAS Name: 5-bromo-N-[[[2-(2-bromo-4-tert-butylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-methoxybenzamide IUPAC Name: 5-bromo-N-[[[2-(2-bromo-4-tert-butylphenoxy)acetyl]amino]carbamothioyl]-2-methoxybenzamide Traditional Name: 5-bromo-N-[[[2-(2-bromo-4-tert-butyl-phenoxy)acetyl]amino]thiocarbamoyl]-2-methoxy-benzamide Formula: C21H23Br2N3O4S MolecularWeight: 573.29802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23Br2N3O4S/c1-21(2,3)12-5-7-17(15(23)9-12)30-11-18(27)25-26-20(31)24-19(28)14-10-13(22)6-8-16(14)29-4/h5-10H,11H2,1-4H3,(H,25,27)(H2,24,26,28,31)