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

Systemtic Name: ethyl 5-[2-(3-methoxy-3-oxidanylidene-propyl)sulfanylpropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[2-(3-methoxy-3-oxo-propyl)sulfanylpropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[2-[(3-methoxy-3-oxopropyl)thio]-1-oxopropyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-(3-methoxy-3-oxopropyl)sulfanylpropanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-[(3-keto-3-methoxy-propyl)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)C1=C(NC(=C1C)C(=O)C(C)SCCC(=O)OC)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)C(C)SCCC(=O)OC)C

InChI

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