2-chloranyl-5-iodanyl-N-[(4-nitrophenyl)carbamothioyl]benzamide

Systemtic Name: 2-chloranyl-5-iodanyl-N-[(4-nitrophenyl)carbamothioyl]benzamide Openeye Name: 2-chloro-5-iodo-N-[(4-nitrophenyl)carbamothioyl]benzamide CAS Name: 2-chloro-5-iodo-N-[(4-nitroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 2-chloro-5-iodo-N-[(4-nitrophenyl)carbamothioyl]benzamide Traditional Name: 2-chloro-5-iodo-N-[(4-nitrophenyl)thiocarbamoyl]benzamide Formula: C14H9ClIN3O3S MolecularWeight: 461.66203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)NC(=O)C2=C(C=CC(=C2)I)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=S)NC(=O)C2=C(C=CC(=C2)I)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H9ClIN3O3S/c15-12-6-1-8(16)7-11(12)13(20)18-14(23)17-9-2-4-10(5-3-9)19(21)22/h1-7H,(H2,17,18,20,23)