N-[(4,6-dimethylpyrimidin-2-yl)carbamothioyl]-3-fluoranyl-benzamide

Systemtic Name: N-[(4,6-dimethylpyrimidin-2-yl)carbamothioyl]-3-fluoranyl-benzamide Openeye Name: N-[(4,6-dimethylpyrimidin-2-yl)carbamothioyl]-3-fluoro-benzamide CAS Name: N-[[(4,6-dimethyl-2-pyrimidinyl)amino]-sulfanylidenemethyl]-3-fluorobenzamide IUPAC Name: N-[(4,6-dimethylpyrimidin-2-yl)carbamothioyl]-3-fluorobenzamide Traditional Name: N-[(4,6-dimethylpyrimidin-2-yl)thiocarbamoyl]-3-fluoro-benzamide Formula: C14H13FN4OS MolecularWeight: 304.342623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=S)NC(=O)C2=CC(=CC=C2)F)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=S)NC(=O)C2=CC(=CC=C2)F)C

InChI

InChI=1S/C14H13FN4OS/c1-8-6-9(2)17-13(16-8)19-14(21)18-12(20)10-4-3-5-11(15)7-10/h3-7H,1-2H3,(H2,16,17,18,19,20,21)