ethyl 4-[(5-chloranyl-2-oxidanylidene-pyrimidin-1-yl)methyl]-2-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-[(5-chloranyl-2-oxidanylidene-pyrimidin-1-yl)methyl]-2-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-[(5-chloro-2-oxo-pyrimidin-1-yl)methyl]-2-methyl-thiazole-5-carboxylate CAS Name: 4-[(5-chloro-2-oxo-1-pyrimidinyl)methyl]-2-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(5-chloro-2-oxopyrimidin-1-yl)methyl]-2-methyl-1,3-thiazole-5-carboxylate Traditional Name: 4-[(5-chloro-2-keto-pyrimidin-1-yl)methyl]-2-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C12H12ClN3O3S MolecularWeight: 313.75998

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)C)CN2C=C(C=NC2=O)Cl

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)C)CN2C=C(C=NC2=O)Cl

InChI

InChI=1S/C12H12ClN3O3S/c1-3-19-11(17)10-9(15-7(2)20-10)6-16-5-8(13)4-14-12(16)18/h4-5H,3,6H2,1-2H3