O4-tert-butyl O2-ethyl 3-methyl-5-[2-(1,3,4-thiadiazol-2-ylsulfanyl)ethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: O4-tert-butyl O2-ethyl 3-methyl-5-[2-(1,3,4-thiadiazol-2-ylsulfanyl)ethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: O4-tert-butyl O2-ethyl 3-methyl-5-[[2-(1,3,4-thiadiazol-2-ylsulfanyl)acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[1-oxo-2-(1,3,4-thiadiazol-2-ylthio)ethyl]amino]thiophene-2,4-dicarboxylic acid O4-tert-butyl ester O2-ethyl ester IUPAC Name: 4-O-tert-butyl 2-O-ethyl 3-methyl-5-[[2-(1,3,4-thiadiazol-2-ylsulfanyl)acetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-(1,3,4-thiadiazol-2-ylthio)acetyl]amino]thiophene-2,4-dicarboxylic acid O4-tert-butyl ester O2-ethyl ester Formula: C17H21N3O5S3 MolecularWeight: 443.56074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)CSC2=NN=CS2)C(=O)OC(C)(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)CSC2=NN=CS2)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C17H21N3O5S3/c1-6-24-15(23)12-9(2)11(14(22)25-17(3,4)5)13(28-12)19-10(21)7-26-16-20-18-8-27-16/h8H,6-7H2,1-5H3,(H,19,21)