4-chloranyl-N-[(4-chloranyl-2-nitro-phenyl)carbamothioyl]-2-ethyl-pyrazole-3-carboxamide

Systemtic Name: 4-chloranyl-N-[(4-chloranyl-2-nitro-phenyl)carbamothioyl]-2-ethyl-pyrazole-3-carboxamide Openeye Name: 4-chloro-N-[(4-chloro-2-nitro-phenyl)carbamothioyl]-2-ethyl-pyrazole-3-carboxamide CAS Name: 4-chloro-N-[(4-chloro-2-nitroanilino)-sulfanylidenemethyl]-2-ethyl-3-pyrazolecarboxamide IUPAC Name: 4-chloro-N-[(4-chloro-2-nitrophenyl)carbamothioyl]-2-ethylpyrazole-3-carboxamide Traditional Name: 4-chloro-N-[(4-chloro-2-nitro-phenyl)thiocarbamoyl]-2-ethyl-pyrazole-3-carboxamide Formula: C13H11Cl2N5O3S MolecularWeight: 388.22914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)Cl)C(=O)NC(=S)NC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCN1C(=C(C=N1)Cl)C(=O)NC(=S)NC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H11Cl2N5O3S/c1-2-19-11(8(15)6-16-19)12(21)18-13(24)17-9-4-3-7(14)5-10(9)20(22)23/h3-6H,2H2,1H3,(H2,17,18,21,24)