methyl 2-[[4-ethyl-3-(furan-2-yl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-propyl-amino]ethanoate

Systemtic Name: methyl 2-[[4-ethyl-3-(furan-2-yl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-propyl-amino]ethanoate Openeye Name: methyl 2-[[4-ethyl-3-(2-furyl)-5-thioxo-1,2,4-triazol-1-yl]methyl-propyl-amino]acetate CAS Name: 2-[[4-ethyl-3-(2-furanyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-propylamino]acetic acid methyl ester IUPAC Name: methyl 2-[[4-ethyl-3-(furan-2-yl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-propylamino]acetate Traditional Name: 2-[[4-ethyl-3-(2-furyl)-5-thioxo-1,2,4-triazol-1-yl]methyl-propyl-amino]acetic acid methyl ester Formula: C15H22N4O3S MolecularWeight: 338.42518

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)OC)CN1C(=S)N(C(=N1)C2=CC=CO2)CC

Isomeric SMILES

CCCN(CC(=O)OC)CN1C(=S)N(C(=N1)C2=CC=CO2)CC

InChI

InChI=1S/C15H22N4O3S/c1-4-8-17(10-13(20)21-3)11-19-15(23)18(5-2)14(16-19)12-7-6-9-22-12/h6-7,9H,4-5,8,10-11H2,1-3H3