ethyl 4-ethanoyl-2-[2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-5-methyl-furan-3-carboxylate

Systemtic Name: ethyl 4-ethanoyl-2-[2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-5-methyl-furan-3-carboxylate Openeye Name: ethyl 4-acetyl-2-[[2-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-5-methyl-furan-3-carboxylate CAS Name: 4-acetyl-2-[[2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]-5-methyl-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 4-acetyl-2-[[2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-5-methylfuran-3-carboxylate Traditional Name: 4-acetyl-2-[[2-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]-5-methyl-furan-3-carboxylic acid ethyl ester Formula: C20H22N4O5S2 MolecularWeight: 462.54248

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=C(C(=C(O2)C)C(=O)C)C(=O)OCC)C3=CC=CS3

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=C(C(=C(O2)C)C(=O)C)C(=O)OCC)C3=CC=CS3

InChI

InChI=1S/C20H22N4O5S2/c1-5-24-17(13-8-7-9-30-13)22-23-20(24)31-10-14(26)21-18-16(19(27)28-6-2)15(11(3)25)12(4)29-18/h7-9H,5-6,10H2,1-4H3,(H,21,26)