N-[[2-[2,4-bis(chloranyl)phenoxy]propanoylamino]carbamothioyl]-3-bromanyl-4-ethoxy-benzamide

Systemtic Name: N-[[2-[2,4-bis(chloranyl)phenoxy]propanoylamino]carbamothioyl]-3-bromanyl-4-ethoxy-benzamide Openeye Name: 3-bromo-N-[[2-(2,4-dichlorophenoxy)propanoylamino]carbamothioyl]-4-ethoxy-benzamide CAS Name: 3-bromo-N-[[[2-(2,4-dichlorophenoxy)-1-oxopropyl]hydrazo]-sulfanylidenemethyl]-4-ethoxybenzamide IUPAC Name: 3-bromo-N-[[2-(2,4-dichlorophenoxy)propanoylamino]carbamothioyl]-4-ethoxybenzamide Traditional Name: 3-bromo-N-[[2-(2,4-dichlorophenoxy)propanoylamino]thiocarbamoyl]-4-ethoxy-benzamide Formula: C19H18BrCl2N3O4S MolecularWeight: 535.23892

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)C(C)OC2=C(C=C(C=C2)Cl)Cl)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)C(C)OC2=C(C=C(C=C2)Cl)Cl)Br

InChI

InChI=1S/C19H18BrCl2N3O4S/c1-3-28-15-6-4-11(8-13(15)20)18(27)23-19(30)25-24-17(26)10(2)29-16-7-5-12(21)9-14(16)22/h4-10H,3H2,1-2H3,(H,24,26)(H2,23,25,27,30)