2-(4-bromanylphenoxy)-N-[[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]carbamothioyl]ethanamide

Systemtic Name: 2-(4-bromanylphenoxy)-N-[[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]carbamothioyl]ethanamide Openeye Name: 2-(4-bromophenoxy)-N-[[(3-chlorobenzothiophene-2-carbonyl)amino]carbamothioyl]acetamide CAS Name: 2-(4-bromophenoxy)-N-[[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-bromophenoxy)-N-[[(3-chloro-1-benzothiophene-2-carbonyl)amino]carbamothioyl]acetamide Traditional Name: 2-(4-bromophenoxy)-N-[[(3-chlorobenzothiophene-2-carbonyl)amino]thiocarbamoyl]acetamide Formula: C18H13BrClN3O3S2 MolecularWeight: 498.80112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)C(=O)NNC(=S)NC(=O)COC3=CC=C(C=C3)Br)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)C(=O)NNC(=S)NC(=O)COC3=CC=C(C=C3)Br)Cl

InChI

InChI=1S/C18H13BrClN3O3S2/c19-10-5-7-11(8-6-10)26-9-14(24)21-18(27)23-22-17(25)16-15(20)12-3-1-2-4-13(12)28-16/h1-8H,9H2,(H,22,25)(H2,21,23,24,27)