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

Systemtic Name: 2-chloranyl-N-[(4,6-dimethylpyrimidin-2-yl)carbamothioyl]-4-methyl-benzamide Openeye Name: 2-chloro-N-[(4,6-dimethylpyrimidin-2-yl)carbamothioyl]-4-methyl-benzamide CAS Name: 2-chloro-N-[[(4,6-dimethyl-2-pyrimidinyl)amino]-sulfanylidenemethyl]-4-methylbenzamide IUPAC Name: 2-chloro-N-[(4,6-dimethylpyrimidin-2-yl)carbamothioyl]-4-methylbenzamide Traditional Name: 2-chloro-N-[(4,6-dimethylpyrimidin-2-yl)thiocarbamoyl]-4-methyl-benzamide Formula: C15H15ClN4OS MolecularWeight: 334.8238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)NC(=S)NC2=NC(=CC(=N2)C)C)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)NC(=S)NC2=NC(=CC(=N2)C)C)Cl

InChI

InChI=1S/C15H15ClN4OS/c1-8-4-5-11(12(16)6-8)13(21)19-15(22)20-14-17-9(2)7-10(3)18-14/h4-7H,1-3H3,(H2,17,18,19,20,21,22)