4-chloranyl-N-[(4-chloranyl-6-methoxy-pyrimidin-2-yl)carbamothioyl]-2-fluoranyl-benzamide

Systemtic Name: 4-chloranyl-N-[(4-chloranyl-6-methoxy-pyrimidin-2-yl)carbamothioyl]-2-fluoranyl-benzamide Openeye Name: 4-chloro-N-[(4-chloro-6-methoxy-pyrimidin-2-yl)carbamothioyl]-2-fluoro-benzamide CAS Name: 4-chloro-N-[[(4-chloro-6-methoxy-2-pyrimidinyl)amino]-sulfanylidenemethyl]-2-fluorobenzamide IUPAC Name: 4-chloro-N-[(4-chloro-6-methoxypyrimidin-2-yl)carbamothioyl]-2-fluorobenzamide Traditional Name: 4-chloro-N-[(4-chloro-6-methoxy-pyrimidin-2-yl)thiocarbamoyl]-2-fluoro-benzamide Formula: C13H9Cl2FN4O2S MolecularWeight: 375.205563

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)NC(=S)NC(=O)C2=C(C=C(C=C2)Cl)F)Cl

Isomeric SMILES

COC1=CC(=NC(=N1)NC(=S)NC(=O)C2=C(C=C(C=C2)Cl)F)Cl

InChI

InChI=1S/C13H9Cl2FN4O2S/c1-22-10-5-9(15)17-12(18-10)20-13(23)19-11(21)7-3-2-6(14)4-8(7)16/h2-5H,1H3,(H2,17,18,19,20,21,23)