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

Systemtic Name: 3-bromanyl-4-butoxy-N-[(2-ethoxyethanoylamino)carbamothioyl]benzamide Openeye Name: 3-bromo-4-butoxy-N-[[(2-ethoxyacetyl)amino]carbamothioyl]benzamide CAS Name: 3-bromo-4-butoxy-N-[[(2-ethoxy-1-oxoethyl)hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-butoxy-N-[[(2-ethoxyacetyl)amino]carbamothioyl]benzamide Traditional Name: 3-bromo-4-butoxy-N-[[(2-ethoxyacetyl)amino]thiocarbamoyl]benzamide Formula: C16H22BrN3O4S MolecularWeight: 432.33258

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22BrN3O4S/c1-3-5-8-24-13-7-6-11(9-12(13)17)15(22)18-16(25)20-19-14(21)10-23-4-2/h6-7,9H,3-5,8,10H2,1-2H3,(H,19,21)(H2,18,20,22,25)