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

Systemtic Name: N-[[2-[2,4-bis(chloranyl)phenoxy]ethanoylamino]carbamothioyl]-3-bromanyl-4-methyl-benzamide Openeye Name: 3-bromo-N-[[[2-(2,4-dichlorophenoxy)acetyl]amino]carbamothioyl]-4-methyl-benzamide CAS Name: 3-bromo-N-[[[2-(2,4-dichlorophenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-4-methylbenzamide IUPAC Name: 3-bromo-N-[[[2-(2,4-dichlorophenoxy)acetyl]amino]carbamothioyl]-4-methylbenzamide Traditional Name: 3-bromo-N-[[[2-(2,4-dichlorophenoxy)acetyl]amino]thiocarbamoyl]-4-methyl-benzamide Formula: C17H14BrCl2N3O3S MolecularWeight: 491.18636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=C(C=C(C=C2)Cl)Cl)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=C(C=C(C=C2)Cl)Cl)Br

InChI

InChI=1S/C17H14BrCl2N3O3S/c1-9-2-3-10(6-12(9)18)16(25)21-17(27)23-22-15(24)8-26-14-5-4-11(19)7-13(14)20/h2-7H,8H2,1H3,(H,22,24)(H2,21,23,25,27)