methyl 2-[2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoyloxy]-2-phenyl-ethanoate

Systemtic Name: methyl 2-[2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoyloxy]-2-phenyl-ethanoate Openeye Name: methyl 2-[2-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]oxy-2-phenyl-acetate CAS Name: 2-[2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-1-oxoethoxy]-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-[2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]oxy-2-phenylacetate Traditional Name: 2-[2-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetyl]oxy-2-phenyl-acetic acid methyl ester Formula: C19H19N3O4S2 MolecularWeight: 417.50186

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)OC(C2=CC=CC=C2)C(=O)OC)C3=CC=CS3

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)OC(C2=CC=CC=C2)C(=O)OC)C3=CC=CS3

InChI

InChI=1S/C19H19N3O4S2/c1-3-22-17(14-10-7-11-27-14)20-21-19(22)28-12-15(23)26-16(18(24)25-2)13-8-5-4-6-9-13/h4-11,16H,3,12H2,1-2H3