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

Systemtic Name: dimethyl 5-[2-(diethylcarbamothioylsulfanyl)ethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 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 dimethyl ester IUPAC Name: dimethyl 5-[[2-(diethylcarbamothioylsulfanyl)acetyl]amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[[2-(diethylthiocarbamoylthio)acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C16H22N2O5S3 MolecularWeight: 418.55128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O5S3/c1-6-18(7-2)16(24)25-8-10(19)17-13-11(14(20)22-4)9(3)12(26-13)15(21)23-5/h6-8H2,1-5H3,(H,17,19)