4-[2-[2,4-bis(bromanyl)phenoxy]ethanoylcarbamothioylamino]benzamide

Systemtic Name: 4-[2-[2,4-bis(bromanyl)phenoxy]ethanoylcarbamothioylamino]benzamide Openeye Name: 4-[[2-(2,4-dibromophenoxy)acetyl]carbamothioylamino]benzamide CAS Name: 4-[[[[2-(2,4-dibromophenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: 4-[[2-(2,4-dibromophenoxy)acetyl]carbamothioylamino]benzamide Traditional Name: 4-[[2-(2,4-dibromophenoxy)acetyl]thiocarbamoylamino]benzamide Formula: C16H13Br2N3O3S MolecularWeight: 487.16572

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)N)NC(=S)NC(=O)COC2=C(C=C(C=C2)Br)Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)N)NC(=S)NC(=O)COC2=C(C=C(C=C2)Br)Br

InChI

InChI=1S/C16H13Br2N3O3S/c17-10-3-6-13(12(18)7-10)24-8-14(22)21-16(25)20-11-4-1-9(2-5-11)15(19)23/h1-7H,8H2,(H2,19,23)(H2,20,21,22,25)