N-[[2-[2,4-bis(bromanyl)-6-methyl-phenoxy]ethanoylamino]carbamothioyl]octanamide

Systemtic Name: N-[[2-[2,4-bis(bromanyl)-6-methyl-phenoxy]ethanoylamino]carbamothioyl]octanamide Openeye Name: N-[[[2-(2,4-dibromo-6-methyl-phenoxy)acetyl]amino]carbamothioyl]octanamide CAS Name: N-[[[2-(2,4-dibromo-6-methylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]octanamide IUPAC Name: N-[[[2-(2,4-dibromo-6-methylphenoxy)acetyl]amino]carbamothioyl]octanamide Traditional Name: N-[[[2-(2,4-dibromo-6-methyl-phenoxy)acetyl]amino]thiocarbamoyl]caprylamide Formula: C18H25Br2N3O3S MolecularWeight: 523.2824

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(=S)NNC(=O)COC1=C(C=C(C=C1C)Br)Br

Isomeric SMILES

CCCCCCCC(=O)NC(=S)NNC(=O)COC1=C(C=C(C=C1C)Br)Br

InChI

InChI=1S/C18H25Br2N3O3S/c1-3-4-5-6-7-8-15(24)21-18(27)23-22-16(25)11-26-17-12(2)9-13(19)10-14(17)20/h9-10H,3-8,11H2,1-2H3,(H,22,25)(H2,21,23,24,27)