diethyl 4-azanyl-5-(2-methylsulfanylethyl)-2,5-dihydropyrrole-1,3-dicarboxylate

Systemtic Name: diethyl 4-azanyl-5-(2-methylsulfanylethyl)-2,5-dihydropyrrole-1,3-dicarboxylate Openeye Name: diethyl 4-amino-5-(2-methylsulfanylethyl)-2,5-dihydropyrrole-1,3-dicarboxylate CAS Name: 4-amino-5-[2-(methylthio)ethyl]-2,5-dihydropyrrole-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-amino-5-(2-methylsulfanylethyl)-2,5-dihydropyrrole-1,3-dicarboxylate Traditional Name: 4-amino-5-[2-(methylthio)ethyl]-3-pyrroline-1,3-dicarboxylic acid diethyl ester Formula: C13H22N2O4S MolecularWeight: 302.38978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(N(C1)C(=O)OCC)CCSC)N

Isomeric SMILES

CCOC(=O)C1=C(C(N(C1)C(=O)OCC)CCSC)N

InChI

InChI=1S/C13H22N2O4S/c1-4-18-12(16)9-8-15(13(17)19-5-2)10(11(9)14)6-7-20-3/h10H,4-8,14H2,1-3H3