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

Systemtic Name: 3-bromanyl-4-butoxy-N-[(3-ethoxypropanoylamino)carbamothioyl]benzamide Openeye Name: 3-bromo-4-butoxy-N-[(3-ethoxypropanoylamino)carbamothioyl]benzamide CAS Name: 3-bromo-4-butoxy-N-[[(3-ethoxy-1-oxopropyl)hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-butoxy-N-[(3-ethoxypropanoylamino)carbamothioyl]benzamide Traditional Name: 3-bromo-4-butoxy-N-[(3-ethoxypropanoylamino)thiocarbamoyl]benzamide Formula: C17H24BrN3O4S MolecularWeight: 446.35916

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)CCOCC)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)CCOCC)Br

InChI

InChI=1S/C17H24BrN3O4S/c1-3-5-9-25-14-7-6-12(11-13(14)18)16(23)19-17(26)21-20-15(22)8-10-24-4-2/h6-7,11H,3-5,8-10H2,1-2H3,(H,20,22)(H2,19,21,23,26)