ethyl 2-[4-(3-ethanoylpyrazol-1-yl)pyrimidin-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[4-(3-ethanoylpyrazol-1-yl)pyrimidin-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[4-(3-acetylpyrazol-1-yl)pyrimidin-2-yl]sulfanylacetate CAS Name: 2-[[4-(3-acetyl-1-pyrazolyl)-2-pyrimidinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(3-acetylpyrazol-1-yl)pyrimidin-2-yl]sulfanylacetate Traditional Name: 2-[[4-(3-acetylpyrazol-1-yl)pyrimidin-2-yl]thio]acetic acid ethyl ester Formula: C13H14N4O3S MolecularWeight: 306.34026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC=CC(=N1)N2C=CC(=N2)C(=O)C

Isomeric SMILES

CCOC(=O)CSC1=NC=CC(=N1)N2C=CC(=N2)C(=O)C

InChI

InChI=1S/C13H14N4O3S/c1-3-20-12(19)8-21-13-14-6-4-11(15-13)17-7-5-10(16-17)9(2)18/h4-7H,3,8H2,1-2H3