potassium 2-[(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)carbonylamino]benzoate

Systemtic Name: potassium 2-[(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)carbonylamino]benzoate Openeye Name: potassium 2-[(5-chloro-2-methylsulfanyl-pyrimidine-4-carbonyl)amino]benzoate CAS Name: potassium 2-[[[5-chloro-2-(methylthio)-4-pyrimidinyl]-oxomethyl]amino]benzoate IUPAC Name: potassium 2-[(5-chloro-2-methylsulfanylpyrimidine-4-carbonyl)amino]benzoate Traditional Name: potassium 2-[[5-chloro-2-(methylthio)pyrimidine-4-carbonyl]amino]benzoate Formula: C13H9ClKN3O3S MolecularWeight: 361.84516

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)NC2=CC=CC=C2C(=O)[O-])Cl.[K+]

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)NC2=CC=CC=C2C(=O)[O-])Cl.[K+]

InChI

InChI=1S/C13H10ClN3O3S.K/c1-21-13-15-6-8(14)10(17-13)11(18)16-9-5-3-2-4-7(9)12(19)20;/h2-6H,1H3,(H,16,18)(H,19,20);/q;+1/p-1