methyl 2-[3-[2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanoylamino]phenoxy]ethanoate

Systemtic Name: methyl 2-[3-[2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanoylamino]phenoxy]ethanoate Openeye Name: methyl 2-[3-[[2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetyl]amino]phenoxy]acetate CAS Name: 2-[3-[[1-oxo-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethyl]amino]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[3-[[2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetyl]amino]phenoxy]acetate Traditional Name: 2-[3-[[2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetyl]amino]phenoxy]acetic acid methyl ester Formula: C17H16N4O4S2 MolecularWeight: 404.46334

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=CC=CC(=C1)NC(=O)CN2C(=NNC2=S)C3=CC=CS3

Isomeric SMILES

COC(=O)COC1=CC=CC(=C1)NC(=O)CN2C(=NNC2=S)C3=CC=CS3

InChI

InChI=1S/C17H16N4O4S2/c1-24-15(23)10-25-12-5-2-4-11(8-12)18-14(22)9-21-16(19-20-17(21)26)13-6-3-7-27-13/h2-8H,9-10H2,1H3,(H,18,22)(H,20,26)