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

Systemtic Name: 2-[2-(2-bromanyl-4-ethyl-phenoxy)ethanoylcarbamothioylamino]-N-phenyl-benzamide Openeye Name: 2-[[2-(2-bromo-4-ethyl-phenoxy)acetyl]carbamothioylamino]-N-phenyl-benzamide CAS Name: 2-[[[[2-(2-bromo-4-ethylphenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]-N-phenylbenzamide IUPAC Name: 2-[[2-(2-bromo-4-ethylphenoxy)acetyl]carbamothioylamino]-N-phenylbenzamide Traditional Name: 2-[[2-(2-bromo-4-ethyl-phenoxy)acetyl]thiocarbamoylamino]-N-phenyl-benzamide Formula: C24H22BrN3O3S MolecularWeight: 512.41878

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC(=O)NC(=S)NC2=CC=CC=C2C(=O)NC3=CC=CC=C3)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC(=O)NC(=S)NC2=CC=CC=C2C(=O)NC3=CC=CC=C3)Br

InChI

InChI=1S/C24H22BrN3O3S/c1-2-16-12-13-21(19(25)14-16)31-15-22(29)28-24(32)27-20-11-7-6-10-18(20)23(30)26-17-8-4-3-5-9-17/h3-14H,2,15H2,1H3,(H,26,30)(H2,27,28,29,32)