3-pentan-3-yl-5-[2-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: 3-pentan-3-yl-5-[2-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: 3-(1-ethylpropyl)-5-[[2-[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 5-[[1-oxo-2-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)thio]ethyl]amino]-3-pentan-3-ylthiophene-2,4-dicarboxylate IUPAC Name: 3-pentan-3-yl-5-[[2-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-(1-ethylpropyl)-5-[[2-[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]thio]acetyl]amino]thiophene-2,4-dicarboxylate Formula: C20H18N4O6S2-2 MolecularWeight: 474.51012

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=C(SC(=C1C(=O)[O-])NC(=O)CSC2=NN=C(O2)C3=CC=NC=C3)C(=O)[O-]

Isomeric SMILES

CCC(CC)C1=C(SC(=C1C(=O)[O-])NC(=O)CSC2=NN=C(O2)C3=CC=NC=C3)C(=O)[O-]

InChI

InChI=1S/C20H20N4O6S2/c1-3-10(4-2)13-14(18(26)27)17(32-15(13)19(28)29)22-12(25)9-31-20-24-23-16(30-20)11-5-7-21-8-6-11/h5-8,10H,3-4,9H2,1-2H3,(H,22,25)(H,26,27)(H,28,29)/p-2