N-[[2-[2,4-bis(bromanyl)phenoxy]ethanoylamino]carbamothioyl]pentanamide

Systemtic Name: N-[[2-[2,4-bis(bromanyl)phenoxy]ethanoylamino]carbamothioyl]pentanamide Openeye Name: N-[[[2-(2,4-dibromophenoxy)acetyl]amino]carbamothioyl]pentanamide CAS Name: N-[[[2-(2,4-dibromophenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]pentanamide IUPAC Name: N-[[[2-(2,4-dibromophenoxy)acetyl]amino]carbamothioyl]pentanamide Traditional Name: N-[[[2-(2,4-dibromophenoxy)acetyl]amino]thiocarbamoyl]valeramide Formula: C14H17Br2N3O3S MolecularWeight: 467.17608

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(=S)NNC(=O)COC1=C(C=C(C=C1)Br)Br

Isomeric SMILES

CCCCC(=O)NC(=S)NNC(=O)COC1=C(C=C(C=C1)Br)Br

InChI

InChI=1S/C14H17Br2N3O3S/c1-2-3-4-12(20)17-14(23)19-18-13(21)8-22-11-6-5-9(15)7-10(11)16/h5-7H,2-4,8H2,1H3,(H,18,21)(H2,17,19,20,23)