ethyl 5-[2-[4-(1,3-dithiolan-2-yl)phenoxy]ethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-[2-[4-(1,3-dithiolan-2-yl)phenoxy]ethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[2-[4-(1,3-dithiolan-2-yl)phenoxy]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[2-[4-(1,3-dithiolan-2-yl)phenoxy]-1-oxoethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-[4-(1,3-dithiolan-2-yl)phenoxy]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-[4-(1,3-dithiolan-2-yl)phenoxy]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C20H23NO4S2 MolecularWeight: 405.53092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)COC2=CC=C(C=C2)C3SCCS3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)COC2=CC=C(C=C2)C3SCCS3)C

InChI

InChI=1S/C20H23NO4S2/c1-4-24-19(23)17-12(2)18(21-13(17)3)16(22)11-25-15-7-5-14(6-8-15)20-26-9-10-27-20/h5-8,20-21H,4,9-11H2,1-3H3