3-bromanyl-N-[[2-(4-bromanylphenoxy)ethanoylamino]carbamothioyl]-4-(2-methoxyethoxy)benzamide

Systemtic Name: 3-bromanyl-N-[[2-(4-bromanylphenoxy)ethanoylamino]carbamothioyl]-4-(2-methoxyethoxy)benzamide Openeye Name: 3-bromo-N-[[[2-(4-bromophenoxy)acetyl]amino]carbamothioyl]-4-(2-methoxyethoxy)benzamide CAS Name: 3-bromo-N-[[[2-(4-bromophenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-4-(2-methoxyethoxy)benzamide IUPAC Name: 3-bromo-N-[[[2-(4-bromophenoxy)acetyl]amino]carbamothioyl]-4-(2-methoxyethoxy)benzamide Traditional Name: 3-bromo-N-[[[2-(4-bromophenoxy)acetyl]amino]thiocarbamoyl]-4-(2-methoxyethoxy)benzamide Formula: C19H19Br2N3O5S MolecularWeight: 561.24426

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=C(C=C2)Br)Br

Isomeric SMILES

COCCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=C(C=C2)Br)Br

InChI

InChI=1S/C19H19Br2N3O5S/c1-27-8-9-28-16-7-2-12(10-15(16)21)18(26)22-19(30)24-23-17(25)11-29-14-5-3-13(20)4-6-14/h2-7,10H,8-9,11H2,1H3,(H,23,25)(H2,22,24,26,30)