5-[(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)carbonylamino]thiophene-2-carboxylic acid

Systemtic Name: 5-[(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)carbonylamino]thiophene-2-carboxylic acid Openeye Name: 5-[(5-chloro-2-methylsulfanyl-pyrimidine-4-carbonyl)amino]thiophene-2-carboxylic acid CAS Name: 5-[[[5-chloro-2-(methylthio)-4-pyrimidinyl]-oxomethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 5-[(5-chloro-2-methylsulfanylpyrimidine-4-carbonyl)amino]thiophene-2-carboxylic acid Traditional Name: 5-[[5-chloro-2-(methylthio)pyrimidine-4-carbonyl]amino]-2-thenoic acid Formula: C11H8ClN3O3S2 MolecularWeight: 329.78252

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)NC2=CC=C(S2)C(=O)O)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)NC2=CC=C(S2)C(=O)O)Cl

InChI

InChI=1S/C11H8ClN3O3S2/c1-19-11-13-4-5(12)8(15-11)9(16)14-7-3-2-6(20-7)10(17)18/h2-4H,1H3,(H,14,16)(H,17,18)