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

Systemtic Name: 3-bromanyl-N-[[2-(4-bromanylphenoxy)ethanoylamino]carbamothioyl]-4-methoxy-benzamide Openeye Name: 3-bromo-N-[[[2-(4-bromophenoxy)acetyl]amino]carbamothioyl]-4-methoxy-benzamide CAS Name: 3-bromo-N-[[[2-(4-bromophenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-4-methoxybenzamide IUPAC Name: 3-bromo-N-[[[2-(4-bromophenoxy)acetyl]amino]carbamothioyl]-4-methoxybenzamide Traditional Name: 3-bromo-N-[[[2-(4-bromophenoxy)acetyl]amino]thiocarbamoyl]-4-methoxy-benzamide Formula: C17H15Br2N3O4S MolecularWeight: 517.1917

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=C(C=C2)Br)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=C(C=C2)Br)Br

InChI

InChI=1S/C17H15Br2N3O4S/c1-25-14-7-2-10(8-13(14)19)16(24)20-17(27)22-21-15(23)9-26-12-5-3-11(18)4-6-12/h2-8H,9H2,1H3,(H,21,23)(H2,20,22,24,27)