diethyl 5-[2-(diethylcarbamothioylsulfanyl)ethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-[2-(diethylcarbamothioylsulfanyl)ethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[[2-(diethylcarbamothioylsulfanyl)acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[2-[[diethylamino(sulfanylidene)methyl]thio]-1-oxoethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[[2-(diethylcarbamothioylsulfanyl)acetyl]amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[[2-(diethylthiocarbamoylthio)acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C18H26N2O5S3 MolecularWeight: 446.60444

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SCC(=O)NC1=C(C(=C(S1)C(=O)OCC)C)C(=O)OCC

Isomeric SMILES

CCN(CC)C(=S)SCC(=O)NC1=C(C(=C(S1)C(=O)OCC)C)C(=O)OCC

InChI

InChI=1S/C18H26N2O5S3/c1-6-20(7-2)18(26)27-10-12(21)19-15-13(16(22)24-8-3)11(5)14(28-15)17(23)25-9-4/h6-10H2,1-5H3,(H,19,21)