2-(4-bromanyl-2-chloranyl-phenoxy)-N-[(2-phenylethanoylamino)carbamothioyl]ethanamide

Systemtic Name: 2-(4-bromanyl-2-chloranyl-phenoxy)-N-[(2-phenylethanoylamino)carbamothioyl]ethanamide Openeye Name: 2-(4-bromo-2-chloro-phenoxy)-N-[[(2-phenylacetyl)amino]carbamothioyl]acetamide CAS Name: 2-(4-bromo-2-chlorophenoxy)-N-[[(1-oxo-2-phenylethyl)hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-bromo-2-chlorophenoxy)-N-[[(2-phenylacetyl)amino]carbamothioyl]acetamide Traditional Name: 2-(4-bromo-2-chloro-phenoxy)-N-[[(2-phenylacetyl)amino]thiocarbamoyl]acetamide Formula: C17H15BrClN3O3S MolecularWeight: 456.7413

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15BrClN3O3S/c18-12-6-7-14(13(19)9-12)25-10-16(24)20-17(26)22-21-15(23)8-11-4-2-1-3-5-11/h1-7,9H,8,10H2,(H,21,23)(H2,20,22,24,26)