5-bromanyl-N-[(2-iodanylphenyl)carbamothioyl]pyridine-3-carboxamide

Systemtic Name: 5-bromanyl-N-[(2-iodanylphenyl)carbamothioyl]pyridine-3-carboxamide Openeye Name: 5-bromo-N-[(2-iodophenyl)carbamothioyl]pyridine-3-carboxamide CAS Name: 5-bromo-N-[(2-iodoanilino)-sulfanylidenemethyl]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-[(2-iodophenyl)carbamothioyl]pyridine-3-carboxamide Traditional Name: 5-bromo-N-[(2-iodophenyl)thiocarbamoyl]nicotinamide Formula: C13H9BrIN3OS MolecularWeight: 462.10353

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H9BrIN3OS/c14-9-5-8(6-16-7-9)12(19)18-13(20)17-11-4-2-1-3-10(11)15/h1-7H,(H2,17,18,19,20)