ethyl (2R)-2-[3-(3-methylpyrazol-1-yl)propanoylamino]-3-sulfanyl-propanoate

Systemtic Name: ethyl (2R)-2-[3-(3-methylpyrazol-1-yl)propanoylamino]-3-sulfanyl-propanoate Openeye Name: ethyl (2R)-2-[3-(3-methylpyrazol-1-yl)propanoylamino]-3-sulfanyl-propanoate CAS Name: (2R)-3-mercapto-2-[[3-(3-methyl-1-pyrazolyl)-1-oxopropyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl (2R)-2-[3-(3-methylpyrazol-1-yl)propanoylamino]-3-sulfanylpropanoate Traditional Name: (2R)-3-mercapto-2-[3-(3-methylpyrazol-1-yl)propanoylamino]propionic acid ethyl ester Formula: C12H19N3O3S MolecularWeight: 285.36256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CS)NC(=O)CCN1C=CC(=N1)C

Isomeric SMILES

CCOC(=O)[C@H](CS)NC(=O)CCN1C=CC(=N1)C

InChI

InChI=1S/C12H19N3O3S/c1-3-18-12(17)10(8-19)13-11(16)5-7-15-6-4-9(2)14-15/h4,6,10,19H,3,5,7-8H2,1-2H3,(H,13,16)/t10-/m0/s1