ethyl (2R)-2-(pyrazolo[1,5-a]pyrimidin-3-ylcarbonylamino)-3-sulfanyl-propanoate

Systemtic Name: ethyl (2R)-2-(pyrazolo[1,5-a]pyrimidin-3-ylcarbonylamino)-3-sulfanyl-propanoate Openeye Name: ethyl (2R)-2-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)-3-sulfanyl-propanoate CAS Name: (2R)-3-mercapto-2-[[oxo(3-pyrazolo[1,5-a]pyrimidinyl)methyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl (2R)-2-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)-3-sulfanylpropanoate Traditional Name: (2R)-3-mercapto-2-(pyrazolo[1,5-a]pyrimidine-3-carbonylamino)propionic acid ethyl ester Formula: C12H14N4O3S MolecularWeight: 294.32956

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CS)NC(=O)C1=C2N=CC=CN2N=C1

Isomeric SMILES

CCOC(=O)[C@H](CS)NC(=O)C1=C2N=CC=CN2N=C1

InChI

InChI=1S/C12H14N4O3S/c1-2-19-12(18)9(7-20)15-11(17)8-6-14-16-5-3-4-13-10(8)16/h3-6,9,20H,2,7H2,1H3,(H,15,17)/t9-/m0/s1