ethyl 5-[(2R)-2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanylpropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-[(2R)-2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanylpropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[(2R)-2-(2-ethoxy-2-oxo-ethyl)sulfanylpropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[(2R)-2-[(2-ethoxy-2-oxoethyl)thio]-1-oxopropyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(2R)-2-(2-ethoxy-2-oxoethyl)sulfanylpropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[(2R)-2-[(2-ethoxy-2-keto-ethyl)thio]propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C16H23NO5S MolecularWeight: 341.42252

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC(C)C(=O)C1=C(C(=C(N1)C)C(=O)OCC)C

Isomeric SMILES

CCOC(=O)CS[C@H](C)C(=O)C1=C(C(=C(N1)C)C(=O)OCC)C

InChI

InChI=1S/C16H23NO5S/c1-6-21-12(18)8-23-11(5)15(19)14-9(3)13(10(4)17-14)16(20)22-7-2/h11,17H,6-8H2,1-5H3/t11-/m1/s1