2-(2-bromanyl-4-ethyl-phenoxy)-N-[[2-(4-nitrophenoxy)ethanoylamino]carbamothioyl]ethanamide

Systemtic Name: 2-(2-bromanyl-4-ethyl-phenoxy)-N-[[2-(4-nitrophenoxy)ethanoylamino]carbamothioyl]ethanamide Openeye Name: 2-(2-bromo-4-ethyl-phenoxy)-N-[[[2-(4-nitrophenoxy)acetyl]amino]carbamothioyl]acetamide CAS Name: 2-(2-bromo-4-ethylphenoxy)-N-[[[2-(4-nitrophenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(2-bromo-4-ethylphenoxy)-N-[[[2-(4-nitrophenoxy)acetyl]amino]carbamothioyl]acetamide Traditional Name: 2-(2-bromo-4-ethyl-phenoxy)-N-[[[2-(4-nitrophenoxy)acetyl]amino]thiocarbamoyl]acetamide Formula: C19H19BrN4O6S MolecularWeight: 511.34636

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC(=O)NC(=S)NNC(=O)COC2=CC=C(C=C2)[N+](=O)[O-])Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC(=O)NC(=S)NNC(=O)COC2=CC=C(C=C2)[N+](=O)[O-])Br

InChI

InChI=1S/C19H19BrN4O6S/c1-2-12-3-8-16(15(20)9-12)30-10-17(25)21-19(31)23-22-18(26)11-29-14-6-4-13(5-7-14)24(27)28/h3-9H,2,10-11H2,1H3,(H,22,26)(H2,21,23,25,31)