5-bromanyl-N-[(3-ethoxypropanoylamino)carbamothioyl]-2-methoxy-benzamide

Systemtic Name: 5-bromanyl-N-[(3-ethoxypropanoylamino)carbamothioyl]-2-methoxy-benzamide Openeye Name: 5-bromo-N-[(3-ethoxypropanoylamino)carbamothioyl]-2-methoxy-benzamide CAS Name: 5-bromo-N-[[(3-ethoxy-1-oxopropyl)hydrazo]-sulfanylidenemethyl]-2-methoxybenzamide IUPAC Name: 5-bromo-N-[(3-ethoxypropanoylamino)carbamothioyl]-2-methoxybenzamide Traditional Name: 5-bromo-N-[(3-ethoxypropanoylamino)thiocarbamoyl]-2-methoxy-benzamide Formula: C14H18BrN3O4S MolecularWeight: 404.27942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18BrN3O4S/c1-3-22-7-6-12(19)17-18-14(23)16-13(20)10-8-9(15)4-5-11(10)21-2/h4-5,8H,3,6-7H2,1-2H3,(H,17,19)(H2,16,18,20,23)