4-chloranyl-2-methylsulfanyl-pyrimidine-5-carboxylate; 1-methylsulfanylethenamine

Systemtic Name: 4-chloranyl-2-methylsulfanyl-pyrimidine-5-carboxylate; 1-methylsulfanylethenamine Openeye Name: 4-chloro-2-methylsulfanyl-pyrimidine-5-carboxylate; 1-methylsulfanylethenamine CAS Name: 4-chloro-2-(methylthio)-5-pyrimidinecarboxylate; 1-(methylthio)ethenamine IUPAC Name: 4-chloro-2-methylsulfanylpyrimidine-5-carboxylate; 1-methylsulfanylethenamine Traditional Name: 4-chloro-2-(methylthio)pyrimidine-5-carboxylate; 1-(methylthio)vinylamine Formula: C9H11ClN3O2S2- MolecularWeight: 292.78554

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)Cl)C(=O)[O-].CSC(=C)N

Isomeric SMILES

CSC1=NC=C(C(=N1)Cl)C(=O)[O-].CSC(=C)N

InChI

InChI=1S/C6H5ClN2O2S.C3H7NS/c1-12-6-8-2-3(5(10)11)4(7)9-6;1-3(4)5-2/h2H,1H3,(H,10,11);1,4H2,2H3/p-1