N-[[(3-bromanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]octanamide

Systemtic Name: N-[[(3-bromanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]octanamide Openeye Name: N-[[(3-bromo-4-methoxy-benzoyl)amino]carbamothioyl]octanamide CAS Name: N-[[[(3-bromo-4-methoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]octanamide IUPAC Name: N-[[(3-bromo-4-methoxybenzoyl)amino]carbamothioyl]octanamide Traditional Name: N-[[(3-bromo-4-methoxy-benzoyl)amino]thiocarbamoyl]caprylamide Formula: C17H24BrN3O3S MolecularWeight: 430.35976

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24BrN3O3S/c1-3-4-5-6-7-8-15(22)19-17(25)21-20-16(23)12-9-10-14(24-2)13(18)11-12/h9-11H,3-8H2,1-2H3,(H,20,23)(H2,19,21,22,25)