2-[2-(2-bromanyl-4-ethyl-phenoxy)ethanoylcarbamothioylamino]benzamide

Systemtic Name: 2-[2-(2-bromanyl-4-ethyl-phenoxy)ethanoylcarbamothioylamino]benzamide Openeye Name: 2-[[2-(2-bromo-4-ethyl-phenoxy)acetyl]carbamothioylamino]benzamide CAS Name: 2-[[[[2-(2-bromo-4-ethylphenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: 2-[[2-(2-bromo-4-ethylphenoxy)acetyl]carbamothioylamino]benzamide Traditional Name: 2-[[2-(2-bromo-4-ethyl-phenoxy)acetyl]thiocarbamoylamino]benzamide Formula: C18H18BrN3O3S MolecularWeight: 436.32282

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC(=O)NC(=S)NC2=CC=CC=C2C(=O)N)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC(=O)NC(=S)NC2=CC=CC=C2C(=O)N)Br

InChI

InChI=1S/C18H18BrN3O3S/c1-2-11-7-8-15(13(19)9-11)25-10-16(23)22-18(26)21-14-6-4-3-5-12(14)17(20)24/h3-9H,2,10H2,1H3,(H2,20,24)(H2,21,22,23,26)