5-bromanyl-2-chloranyl-N-(pyridin-3-ylmethylcarbamothioyl)benzamide

Systemtic Name: 5-bromanyl-2-chloranyl-N-(pyridin-3-ylmethylcarbamothioyl)benzamide Openeye Name: 5-bromo-2-chloro-N-(3-pyridylmethylcarbamothioyl)benzamide CAS Name: 5-bromo-2-chloro-N-[(3-pyridinylmethylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-chloro-N-(pyridin-3-ylmethylcarbamothioyl)benzamide Traditional Name: 5-bromo-2-chloro-N-(3-pyridylmethylthiocarbamoyl)benzamide Formula: C14H11BrClN3OS MolecularWeight: 384.67864

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11BrClN3OS/c15-10-3-4-12(16)11(6-10)13(20)19-14(21)18-8-9-2-1-5-17-7-9/h1-7H,8H2,(H2,18,19,20,21)