N-[[2-(4-bromanyl-2-chloranyl-phenoxy)ethanoylamino]carbamothioyl]-2-methyl-propanamide

Systemtic Name: N-[[2-(4-bromanyl-2-chloranyl-phenoxy)ethanoylamino]carbamothioyl]-2-methyl-propanamide Openeye Name: N-[[[2-(4-bromo-2-chloro-phenoxy)acetyl]amino]carbamothioyl]-2-methyl-propanamide CAS Name: N-[[[2-(4-bromo-2-chlorophenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-methylpropanamide IUPAC Name: N-[[[2-(4-bromo-2-chlorophenoxy)acetyl]amino]carbamothioyl]-2-methylpropanamide Traditional Name: N-[[[2-(4-bromo-2-chloro-phenoxy)acetyl]amino]thiocarbamoyl]-2-methyl-propionamide Formula: C13H15BrClN3O3S MolecularWeight: 408.6985

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15BrClN3O3S/c1-7(2)12(20)16-13(22)18-17-11(19)6-21-10-4-3-8(14)5-9(10)15/h3-5,7H,6H2,1-2H3,(H,17,19)(H2,16,18,20,22)