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

Systemtic Name: 5-bromanyl-N-[(3-chlorophenyl)carbamothioyl]pyridine-3-carboxamide Openeye Name: 5-bromo-N-[(3-chlorophenyl)carbamothioyl]pyridine-3-carboxamide CAS Name: 5-bromo-N-[(3-chloroanilino)-sulfanylidenemethyl]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-[(3-chlorophenyl)carbamothioyl]pyridine-3-carboxamide Traditional Name: 5-bromo-N-[(3-chlorophenyl)thiocarbamoyl]nicotinamide Formula: C13H9BrClN3OS MolecularWeight: 370.65206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H9BrClN3OS/c14-9-4-8(6-16-7-9)12(19)18-13(20)17-11-3-1-2-10(15)5-11/h1-7H,(H2,17,18,19,20)