diethyl 5-[2-(1,3,4-thiadiazol-2-ylsulfanyl)ethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: diethyl 5-[2-(1,3,4-thiadiazol-2-ylsulfanyl)ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: diethyl 5-[[2-(1,3,4-thiadiazol-2-ylsulfanyl)acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[1-oxo-2-(1,3,4-thiadiazol-2-ylthio)ethyl]amino]benzene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[[2-(1,3,4-thiadiazol-2-ylsulfanyl)acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-(1,3,4-thiadiazol-2-ylthio)acetyl]amino]benzene-1,3-dicarboxylic acid diethyl ester Formula: C16H17N3O5S2 MolecularWeight: 395.45328

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)NC(=O)CSC2=NN=CS2)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)NC(=O)CSC2=NN=CS2)C(=O)OCC

InChI

InChI=1S/C16H17N3O5S2/c1-3-23-14(21)10-5-11(15(22)24-4-2)7-12(6-10)18-13(20)8-25-16-19-17-9-26-16/h5-7,9H,3-4,8H2,1-2H3,(H,18,20)