2-(4-chloranylphenoxy)-N-[(5-nitro-2-oxidanyl-phenyl)carbamothioyl]ethanamide

Systemtic Name: 2-(4-chloranylphenoxy)-N-[(5-nitro-2-oxidanyl-phenyl)carbamothioyl]ethanamide Openeye Name: 2-(4-chlorophenoxy)-N-[(2-hydroxy-5-nitro-phenyl)carbamothioyl]acetamide CAS Name: 2-(4-chlorophenoxy)-N-[(2-hydroxy-5-nitroanilino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-chlorophenoxy)-N-[(2-hydroxy-5-nitrophenyl)carbamothioyl]acetamide Traditional Name: 2-(4-chlorophenoxy)-N-[(2-hydroxy-5-nitro-phenyl)thiocarbamoyl]acetamide Formula: C15H12ClN3O5S MolecularWeight: 381.79088

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCC(=O)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])O)Cl

Isomeric SMILES

C1=CC(=CC=C1OCC(=O)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])O)Cl

InChI

InChI=1S/C15H12ClN3O5S/c16-9-1-4-11(5-2-9)24-8-14(21)18-15(25)17-12-7-10(19(22)23)3-6-13(12)20/h1-7,20H,8H2,(H2,17,18,21,25)