N-[[2-(4-bromanylphenoxy)ethanoylamino]carbamothioyl]octanamide

Systemtic Name: N-[[2-(4-bromanylphenoxy)ethanoylamino]carbamothioyl]octanamide Openeye Name: N-[[[2-(4-bromophenoxy)acetyl]amino]carbamothioyl]octanamide CAS Name: N-[[[2-(4-bromophenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]octanamide IUPAC Name: N-[[[2-(4-bromophenoxy)acetyl]amino]carbamothioyl]octanamide Traditional Name: N-[[[2-(4-bromophenoxy)acetyl]amino]thiocarbamoyl]caprylamide Formula: C17H24BrN3O3S MolecularWeight: 430.35976

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24BrN3O3S/c1-2-3-4-5-6-7-15(22)19-17(25)21-20-16(23)12-24-14-10-8-13(18)9-11-14/h8-11H,2-7,12H2,1H3,(H,20,23)(H2,19,21,22,25)