methyl 3-[(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)carbonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[(5-chloro-2-methylsulfanyl-pyrimidine-4-carbonyl)amino]thiophene-2-carboxylate CAS Name: 3-[[[5-chloro-2-(methylthio)-4-pyrimidinyl]-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(5-chloro-2-methylsulfanylpyrimidine-4-carbonyl)amino]thiophene-2-carboxylate Traditional Name: 3-[[5-chloro-2-(methylthio)pyrimidine-4-carbonyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C12H10ClN3O3S2 MolecularWeight: 343.8091

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=O)C2=NC(=NC=C2Cl)SC

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=O)C2=NC(=NC=C2Cl)SC

InChI

InChI=1S/C12H10ClN3O3S2/c1-19-11(18)9-7(3-4-21-9)15-10(17)8-6(13)5-14-12(16-8)20-2/h3-5H,1-2H3,(H,15,17)