2-[(3-chloranyl-4-fluoranyl-phenyl)amino]pyridine-4-carbothioamide

Systemtic Name: 2-[(3-chloranyl-4-fluoranyl-phenyl)amino]pyridine-4-carbothioamide Openeye Name: 2-(3-chloro-4-fluoro-anilino)pyridine-4-carbothioamide CAS Name: 2-(3-chloro-4-fluoroanilino)-4-pyridinecarbothioamide IUPAC Name: 2-(3-chloro-4-fluoroanilino)pyridine-4-carbothioamide Traditional Name: 2-(3-chloro-4-fluoro-anilino)thioisonicotinamide Formula: C12H9ClFN3S MolecularWeight: 281.736363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC2=NC=CC(=C2)C(=S)N)Cl)F

Isomeric SMILES

C1=CC(=C(C=C1NC2=NC=CC(=C2)C(=S)N)Cl)F

InChI

InChI=1S/C12H9ClFN3S/c13-9-6-8(1-2-10(9)14)17-11-5-7(12(15)18)3-4-16-11/h1-6H,(H2,15,18)(H,16,17)