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

Systemtic Name: methyl 2-[3-[2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanoylamino]phenoxy]ethanoate Openeye Name: methyl 2-[3-[[2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetyl]amino]phenoxy]acetate CAS Name: 2-[3-[[1-oxo-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethyl]amino]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[3-[[2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetyl]amino]phenoxy]acetate Traditional Name: 2-[3-[[2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetyl]amino]phenoxy]acetic acid methyl ester Formula: C16H20N4O4S MolecularWeight: 364.4194

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1CC(=O)NC2=CC(=CC=C2)OCC(=O)OC

Isomeric SMILES

CCCC1=NNC(=S)N1CC(=O)NC2=CC(=CC=C2)OCC(=O)OC

InChI

InChI=1S/C16H20N4O4S/c1-3-5-13-18-19-16(25)20(13)9-14(21)17-11-6-4-7-12(8-11)24-10-15(22)23-2/h4,6-8H,3,5,9-10H2,1-2H3,(H,17,21)(H,19,25)