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

Systemtic Name: 2-[(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)carbonylamino]benzoate Openeye Name: 2-[(5-chloro-2-methylsulfanyl-pyrimidine-4-carbonyl)amino]benzoate CAS Name: 2-[[[5-chloro-2-(methylthio)-4-pyrimidinyl]-oxomethyl]amino]benzoate IUPAC Name: 2-[(5-chloro-2-methylsulfanylpyrimidine-4-carbonyl)amino]benzoate Traditional Name: 2-[[5-chloro-2-(methylthio)pyrimidine-4-carbonyl]amino]benzoate Formula: C13H9ClN3O3S- MolecularWeight: 322.74686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10ClN3O3S/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)/p-1