4-chloranyl-3-nitro-N-(pyridin-2-ylcarbamothioyl)benzamide

Systemtic Name: 4-chloranyl-3-nitro-N-(pyridin-2-ylcarbamothioyl)benzamide Openeye Name: 4-chloro-3-nitro-N-(2-pyridylcarbamothioyl)benzamide CAS Name: 4-chloro-3-nitro-N-[(2-pyridinylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-chloro-3-nitro-N-(pyridin-2-ylcarbamothioyl)benzamide Traditional Name: 4-chloro-3-nitro-N-(2-pyridylthiocarbamoyl)benzamide Formula: C13H9ClN4O3S MolecularWeight: 336.75356

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H9ClN4O3S/c14-9-5-4-8(7-10(9)18(20)21)12(19)17-13(22)16-11-3-1-2-6-15-11/h1-7H,(H2,15,16,17,19,22)