diethyl 3-azanyl-5-methylsulfanyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: diethyl 3-azanyl-5-methylsulfanyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: diethyl 3-amino-5-methylsulfanyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3-amino-5-(methylthio)-1H-pyrrole-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-amino-5-methylsulfanyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3-amino-5-(methylthio)-1H-pyrrole-2,4-dicarboxylic acid diethyl ester Formula: C11H16N2O4S MolecularWeight: 272.32074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1N)C(=O)OCC)SC

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1N)C(=O)OCC)SC

InChI

InChI=1S/C11H16N2O4S/c1-4-16-10(14)6-7(12)8(11(15)17-5-2)13-9(6)18-3/h13H,4-5,12H2,1-3H3