5-bromanyl-N-[(2-chloranyl-4-iodanyl-phenyl)carbamothioyl]pyridine-3-carboxamide

Systemtic Name: 5-bromanyl-N-[(2-chloranyl-4-iodanyl-phenyl)carbamothioyl]pyridine-3-carboxamide Openeye Name: 5-bromo-N-[(2-chloro-4-iodo-phenyl)carbamothioyl]pyridine-3-carboxamide CAS Name: 5-bromo-N-[(2-chloro-4-iodoanilino)-sulfanylidenemethyl]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-[(2-chloro-4-iodophenyl)carbamothioyl]pyridine-3-carboxamide Traditional Name: 5-bromo-N-[(2-chloro-4-iodo-phenyl)thiocarbamoyl]nicotinamide Formula: C13H8BrClIN3OS MolecularWeight: 496.54859

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1I)Cl)NC(=S)NC(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

C1=CC(=C(C=C1I)Cl)NC(=S)NC(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C13H8BrClIN3OS/c14-8-3-7(5-17-6-8)12(20)19-13(21)18-11-2-1-9(16)4-10(11)15/h1-6H,(H2,18,19,20,21)