3-bromanyl-4-ethoxy-N-[(2-ethoxyethanoylamino)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-ethoxy-N-[(2-ethoxyethanoylamino)carbamothioyl]benzamide Openeye Name: 3-bromo-4-ethoxy-N-[[(2-ethoxyacetyl)amino]carbamothioyl]benzamide CAS Name: 3-bromo-4-ethoxy-N-[[(2-ethoxy-1-oxoethyl)hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-ethoxy-N-[[(2-ethoxyacetyl)amino]carbamothioyl]benzamide Traditional Name: 3-bromo-4-ethoxy-N-[[(2-ethoxyacetyl)amino]thiocarbamoyl]benzamide Formula: C14H18BrN3O4S MolecularWeight: 404.27942

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC(=O)NNC(=S)NC(=O)C1=CC(=C(C=C1)OCC)Br

Isomeric SMILES

CCOCC(=O)NNC(=S)NC(=O)C1=CC(=C(C=C1)OCC)Br

InChI

InChI=1S/C14H18BrN3O4S/c1-3-21-8-12(19)17-18-14(23)16-13(20)9-5-6-11(22-4-2)10(15)7-9/h5-7H,3-4,8H2,1-2H3,(H,17,19)(H2,16,18,20,23)