N'-(4-chloranyl-3-nitro-phenyl)carbonyl-2-[(3-nitrophenyl)methylsulfanyl]pyridine-3-carbohydrazide

Systemtic Name: N'-(4-chloranyl-3-nitro-phenyl)carbonyl-2-[(3-nitrophenyl)methylsulfanyl]pyridine-3-carbohydrazide Openeye Name: N'-(4-chloro-3-nitro-benzoyl)-2-[(3-nitrophenyl)methylsulfanyl]pyridine-3-carbohydrazide CAS Name: N'-[(4-chloro-3-nitrophenyl)-oxomethyl]-2-[(3-nitrophenyl)methylthio]-3-pyridinecarbohydrazide IUPAC Name: N'-(4-chloro-3-nitrobenzoyl)-2-[(3-nitrophenyl)methylsulfanyl]pyridine-3-carbohydrazide Traditional Name: N'-(4-chloro-3-nitro-benzoyl)-2-[(3-nitrobenzyl)thio]nicotinohydrazide Formula: C20H14ClN5O6S MolecularWeight: 487.87306

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CSC2=C(C=CC=N2)C(=O)NNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CSC2=C(C=CC=N2)C(=O)NNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H14ClN5O6S/c21-16-7-6-13(10-17(16)26(31)32)18(27)23-24-19(28)15-5-2-8-22-20(15)33-11-12-3-1-4-14(9-12)25(29)30/h1-10H,11H2,(H,23,27)(H,24,28)