3-bromanyl-N-[(3-ethoxypropanoylamino)carbamothioyl]-4-propoxy-benzamide

Systemtic Name: 3-bromanyl-N-[(3-ethoxypropanoylamino)carbamothioyl]-4-propoxy-benzamide Openeye Name: 3-bromo-N-[(3-ethoxypropanoylamino)carbamothioyl]-4-propoxy-benzamide CAS Name: 3-bromo-N-[[(3-ethoxy-1-oxopropyl)hydrazo]-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: 3-bromo-N-[(3-ethoxypropanoylamino)carbamothioyl]-4-propoxybenzamide Traditional Name: 3-bromo-N-[(3-ethoxypropanoylamino)thiocarbamoyl]-4-propoxy-benzamide Formula: C16H22BrN3O4S MolecularWeight: 432.33258

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)CCOCC)Br

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)CCOCC)Br

InChI

InChI=1S/C16H22BrN3O4S/c1-3-8-24-13-6-5-11(10-12(13)17)15(22)18-16(25)20-19-14(21)7-9-23-4-2/h5-6,10H,3-4,7-9H2,1-2H3,(H,19,21)(H2,18,20,22,25)