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

Systemtic Name: N-[(4-chloranyl-3-nitro-phenyl)carbamothioyl]-2-(4-nitrophenoxy)ethanamide Openeye Name: N-[(4-chloro-3-nitro-phenyl)carbamothioyl]-2-(4-nitrophenoxy)acetamide CAS Name: N-[(4-chloro-3-nitroanilino)-sulfanylidenemethyl]-2-(4-nitrophenoxy)acetamide IUPAC Name: N-[(4-chloro-3-nitrophenyl)carbamothioyl]-2-(4-nitrophenoxy)acetamide Traditional Name: N-[(4-chloro-3-nitro-phenyl)thiocarbamoyl]-2-(4-nitrophenoxy)acetamide Formula: C15H11ClN4O6S MolecularWeight: 410.78904

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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)Cl)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C15H11ClN4O6S/c16-12-6-1-9(7-13(12)20(24)25)17-15(27)18-14(21)8-26-11-4-2-10(3-5-11)19(22)23/h1-7H,8H2,(H2,17,18,21,27)