methyl 5-azanyl-1-(6-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)pyrazole-4-carboxylate

Systemtic Name: methyl 5-azanyl-1-(6-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)pyrazole-4-carboxylate Openeye Name: methyl 5-amino-1-(6-chloro-2-methylsulfanyl-pyrimidin-4-yl)pyrazole-4-carboxylate CAS Name: 5-amino-1-[6-chloro-2-(methylthio)-4-pyrimidinyl]-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-amino-1-(6-chloro-2-methylsulfanylpyrimidin-4-yl)pyrazole-4-carboxylate Traditional Name: 5-amino-1-[6-chloro-2-(methylthio)pyrimidin-4-yl]pyrazole-4-carboxylic acid methyl ester Formula: C10H10ClN5O2S MolecularWeight: 299.7367

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(N=C1)C2=CC(=NC(=N2)SC)Cl)N

Isomeric SMILES

COC(=O)C1=C(N(N=C1)C2=CC(=NC(=N2)SC)Cl)N

InChI

InChI=1S/C10H10ClN5O2S/c1-18-9(17)5-4-13-16(8(5)12)7-3-6(11)14-10(15-7)19-2/h3-4H,12H2,1-2H3