5-bromanyl-N-[[2-(4-ethylphenoxy)ethanoylamino]carbamothioyl]-2-propoxy-benzamide

Systemtic Name: 5-bromanyl-N-[[2-(4-ethylphenoxy)ethanoylamino]carbamothioyl]-2-propoxy-benzamide Openeye Name: 5-bromo-N-[[[2-(4-ethylphenoxy)acetyl]amino]carbamothioyl]-2-propoxy-benzamide CAS Name: 5-bromo-N-[[[2-(4-ethylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-propoxybenzamide IUPAC Name: 5-bromo-N-[[[2-(4-ethylphenoxy)acetyl]amino]carbamothioyl]-2-propoxybenzamide Traditional Name: 5-bromo-N-[[[2-(4-ethylphenoxy)acetyl]amino]thiocarbamoyl]-2-propoxy-benzamide Formula: C21H24BrN3O4S MolecularWeight: 494.40196

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NNC(=O)COC2=CC=C(C=C2)CC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NNC(=O)COC2=CC=C(C=C2)CC

InChI

InChI=1S/C21H24BrN3O4S/c1-3-11-28-18-10-7-15(22)12-17(18)20(27)23-21(30)25-24-19(26)13-29-16-8-5-14(4-2)6-9-16/h5-10,12H,3-4,11,13H2,1-2H3,(H,24,26)(H2,23,25,27,30)