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

Systemtic Name: methyl 3-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propanoate Openeye Name: methyl 3-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propanoate CAS Name: 3-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propanoate Traditional Name: 3-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]propionic acid methyl ester Formula: C14H17N3O3S MolecularWeight: 307.36808

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCC(=O)OC)C2=CC=C(C=C2)OC

Isomeric SMILES

CN1C(=NN=C1SCCC(=O)OC)C2=CC=C(C=C2)OC

InChI

InChI=1S/C14H17N3O3S/c1-17-13(10-4-6-11(19-2)7-5-10)15-16-14(17)21-9-8-12(18)20-3/h4-7H,8-9H2,1-3H3