ethyl (2R)-2-[2-(4-methylpyrazol-1-yl)propanoylamino]-3-sulfanyl-propanoate

Systemtic Name: ethyl (2R)-2-[2-(4-methylpyrazol-1-yl)propanoylamino]-3-sulfanyl-propanoate Openeye Name: ethyl (2R)-2-[2-(4-methylpyrazol-1-yl)propanoylamino]-3-sulfanyl-propanoate CAS Name: (2R)-3-mercapto-2-[[2-(4-methyl-1-pyrazolyl)-1-oxopropyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl (2R)-2-[2-(4-methylpyrazol-1-yl)propanoylamino]-3-sulfanylpropanoate Traditional Name: (2R)-3-mercapto-2-[2-(4-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)C(C)N1C=C(C=N1)C

Isomeric SMILES

CCOC(=O)[C@H](CS)NC(=O)C(C)N1C=C(C=N1)C

InChI

InChI=1S/C12H19N3O3S/c1-4-18-12(17)10(7-19)14-11(16)9(3)15-6-8(2)5-13-15/h5-6,9-10,19H,4,7H2,1-3H3,(H,14,16)/t9?,10-/m0/s1