ethyl 2,5-dimethyl-4-[2-[4-(5-methylthiophen-2-yl)-4-oxidanylidene-butanoyl]oxyethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-4-[2-[4-(5-methylthiophen-2-yl)-4-oxidanylidene-butanoyl]oxyethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,5-dimethyl-4-[2-[4-(5-methyl-2-thienyl)-4-oxo-butanoyl]oxyacetyl]-1H-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-4-[2-[4-(5-methyl-2-thiophenyl)-1,4-dioxobutoxy]-1-oxoethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-4-[2-[4-(5-methylthiophen-2-yl)-4-oxobutanoyl]oxyacetyl]-1H-pyrrole-3-carboxylate Traditional Name: 4-[2-[4-keto-4-(5-methyl-2-thienyl)butanoyl]oxyacetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C20H23NO6S MolecularWeight: 405.46472

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C(=O)COC(=O)CCC(=O)C2=CC=C(S2)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C(=O)COC(=O)CCC(=O)C2=CC=C(S2)C)C)C

InChI

InChI=1S/C20H23NO6S/c1-5-26-20(25)19-13(4)21-12(3)18(19)15(23)10-27-17(24)9-7-14(22)16-8-6-11(2)28-16/h6,8,21H,5,7,9-10H2,1-4H3