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

Systemtic Name: methyl 3-[[5-(2-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanoate Openeye Name: methyl 3-[[5-(2-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanoate CAS Name: 3-[[5-(2-methoxyphenyl)-1H-1,2,4-triazol-3-yl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[[5-(2-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanoate Traditional Name: 3-[[5-(2-methoxyphenyl)-1H-1,2,4-triazol-3-yl]thio]propionic acid methyl ester Formula: C13H15N3O3S MolecularWeight: 293.3415

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NC(=NN2)SCCC(=O)OC

Isomeric SMILES

COC1=CC=CC=C1C2=NC(=NN2)SCCC(=O)OC

InChI

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