N-[[2-(2-bromanyl-4-ethyl-phenoxy)ethanoylamino]carbamothioyl]-2,4-bis(chloranyl)benzamide

Systemtic Name: N-[[2-(2-bromanyl-4-ethyl-phenoxy)ethanoylamino]carbamothioyl]-2,4-bis(chloranyl)benzamide Openeye Name: N-[[[2-(2-bromo-4-ethyl-phenoxy)acetyl]amino]carbamothioyl]-2,4-dichloro-benzamide CAS Name: N-[[[2-(2-bromo-4-ethylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2,4-dichlorobenzamide IUPAC Name: N-[[[2-(2-bromo-4-ethylphenoxy)acetyl]amino]carbamothioyl]-2,4-dichlorobenzamide Traditional Name: N-[[[2-(2-bromo-4-ethyl-phenoxy)acetyl]amino]thiocarbamoyl]-2,4-dichloro-benzamide Formula: C18H16BrCl2N3O3S MolecularWeight: 505.21294

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC(=O)NNC(=S)NC(=O)C2=C(C=C(C=C2)Cl)Cl)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC(=O)NNC(=S)NC(=O)C2=C(C=C(C=C2)Cl)Cl)Br

InChI

InChI=1S/C18H16BrCl2N3O3S/c1-2-10-3-6-15(13(19)7-10)27-9-16(25)23-24-18(28)22-17(26)12-5-4-11(20)8-14(12)21/h3-8H,2,9H2,1H3,(H,23,25)(H2,22,24,26,28)