2-chloranyl-N-[(4,6-dimethylpyrimidin-2-yl)carbamothioyl]-5-iodanyl-benzamide

Systemtic Name: 2-chloranyl-N-[(4,6-dimethylpyrimidin-2-yl)carbamothioyl]-5-iodanyl-benzamide Openeye Name: 2-chloro-N-[(4,6-dimethylpyrimidin-2-yl)carbamothioyl]-5-iodo-benzamide CAS Name: 2-chloro-N-[[(4,6-dimethyl-2-pyrimidinyl)amino]-sulfanylidenemethyl]-5-iodobenzamide IUPAC Name: 2-chloro-N-[(4,6-dimethylpyrimidin-2-yl)carbamothioyl]-5-iodobenzamide Traditional Name: 2-chloro-N-[(4,6-dimethylpyrimidin-2-yl)thiocarbamoyl]-5-iodo-benzamide Formula: C14H12ClIN4OS MolecularWeight: 446.69375

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=S)NC(=O)C2=C(C=CC(=C2)I)Cl)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=S)NC(=O)C2=C(C=CC(=C2)I)Cl)C

InChI

InChI=1S/C14H12ClIN4OS/c1-7-5-8(2)18-13(17-7)20-14(22)19-12(21)10-6-9(16)3-4-11(10)15/h3-6H,1-2H3,(H2,17,18,19,20,21,22)