1-[(2R)-1-oxidanylidene-1-thiomorpholin-4-yl-propan-2-yl]pyrazole-4-carboxylate

Systemtic Name: 1-[(2R)-1-oxidanylidene-1-thiomorpholin-4-yl-propan-2-yl]pyrazole-4-carboxylate Openeye Name: 1-[(1R)-1-methyl-2-oxo-2-thiomorpholino-ethyl]pyrazole-4-carboxylate CAS Name: 1-[(2R)-1-oxo-1-thiomorpholin-4-ylpropan-2-yl]-4-pyrazolecarboxylate IUPAC Name: 1-[(2R)-1-oxo-1-thiomorpholin-4-ylpropan-2-yl]pyrazole-4-carboxylate Traditional Name: 1-[(1R)-2-keto-1-methyl-2-thiomorpholino-ethyl]pyrazole-4-carboxylate Formula: C11H14N3O3S- MolecularWeight: 268.31216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCSCC1)N2C=C(C=N2)C(=O)[O-]

Isomeric SMILES

C[C@H](C(=O)N1CCSCC1)N2C=C(C=N2)C(=O)[O-]

InChI

InChI=1S/C11H15N3O3S/c1-8(10(15)13-2-4-18-5-3-13)14-7-9(6-12-14)11(16)17/h6-8H,2-5H2,1H3,(H,16,17)/p-1/t8-/m1/s1