N-[(4-bromanyl-3-chloranyl-phenyl)carbamothioyl]-2-(4-nitrophenoxy)ethanamide

Systemtic Name: N-[(4-bromanyl-3-chloranyl-phenyl)carbamothioyl]-2-(4-nitrophenoxy)ethanamide Openeye Name: N-[(4-bromo-3-chloro-phenyl)carbamothioyl]-2-(4-nitrophenoxy)acetamide CAS Name: N-[(4-bromo-3-chloroanilino)-sulfanylidenemethyl]-2-(4-nitrophenoxy)acetamide IUPAC Name: N-[(4-bromo-3-chlorophenyl)carbamothioyl]-2-(4-nitrophenoxy)acetamide Traditional Name: N-[(4-bromo-3-chloro-phenyl)thiocarbamoyl]-2-(4-nitrophenoxy)acetamide Formula: C15H11BrClN3O4S MolecularWeight: 444.68754

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])OCC(=O)NC(=S)NC2=CC(=C(C=C2)Br)Cl

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])OCC(=O)NC(=S)NC2=CC(=C(C=C2)Br)Cl

InChI

InChI=1S/C15H11BrClN3O4S/c16-12-6-1-9(7-13(12)17)18-15(25)19-14(21)8-24-11-4-2-10(3-5-11)20(22)23/h1-7H,8H2,(H2,18,19,21,25)