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

Systemtic Name: (2R)-2-[[4-methyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]propanoate Openeye Name: (2R)-2-[[4-methyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]propanoate CAS Name: (2R)-2-[[4-methyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]thio]propanoate IUPAC Name: (2R)-2-[[4-methyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]propanoate Traditional Name: (2R)-2-[[4-methyl-5-(phenoxymethyl)-1,2,4-triazol-3-yl]thio]propionate Formula: C13H14N3O3S- MolecularWeight: 292.33356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])SC1=NN=C(N1C)COC2=CC=CC=C2

Isomeric SMILES

C[C@H](C(=O)[O-])SC1=NN=C(N1C)COC2=CC=CC=C2

InChI

InChI=1S/C13H15N3O3S/c1-9(12(17)18)20-13-15-14-11(16(13)2)8-19-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H,17,18)/p-1/t9-/m1/s1