methyl 5-[2-(diethylcarbamothioylsulfanyl)ethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-[2-(diethylcarbamothioylsulfanyl)ethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[2-(diethylcarbamothioylsulfanyl)acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[2-[[diethylamino(sulfanylidene)methyl]thio]-1-oxoethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[2-(diethylcarbamothioylsulfanyl)acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-(diethylthiocarbamoylthio)acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C15H22N2O3S2 MolecularWeight: 342.47678

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SCC(=O)C1=C(C(=C(N1)C)C(=O)OC)C

Isomeric SMILES

CCN(CC)C(=S)SCC(=O)C1=C(C(=C(N1)C)C(=O)OC)C

InChI

InChI=1S/C15H22N2O3S2/c1-6-17(7-2)15(21)22-8-11(18)13-9(3)12(10(4)16-13)14(19)20-5/h16H,6-8H2,1-5H3