(2R)-2-[(5-cyclohexyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]propanoate

Systemtic Name: (2R)-2-[(5-cyclohexyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]propanoate Openeye Name: (2R)-2-[(5-cyclohexyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]propanoate CAS Name: (2R)-2-[(5-cyclohexyl-4-ethyl-1,2,4-triazol-3-yl)thio]propanoate IUPAC Name: (2R)-2-[(5-cyclohexyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]propanoate Traditional Name: (2R)-2-[(5-cyclohexyl-4-ethyl-1,2,4-triazol-3-yl)thio]propionate Formula: C13H20N3O2S- MolecularWeight: 282.3818

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC(C)C(=O)[O-])C2CCCCC2

Isomeric SMILES

CCN1C(=NN=C1S[C@H](C)C(=O)[O-])C2CCCCC2

InChI

InChI=1S/C13H21N3O2S/c1-3-16-11(10-7-5-4-6-8-10)14-15-13(16)19-9(2)12(17)18/h9-10H,3-8H2,1-2H3,(H,17,18)/p-1/t9-/m1/s1