ethyl 2,4-dimethyl-5-[2-(2,3,5,6-tetramethylphenyl)sulfanylethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[2-(2,3,5,6-tetramethylphenyl)sulfanylethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-[2-(2,3,5,6-tetramethylphenyl)sulfanylacetyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[1-oxo-2-[(2,3,5,6-tetramethylphenyl)thio]ethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[2-(2,3,5,6-tetramethylphenyl)sulfanylacetyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[2-[(2,3,5,6-tetramethylphenyl)thio]acetyl]-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C21H27NO3S MolecularWeight: 373.50898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)CSC2=C(C(=CC(=C2C)C)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)CSC2=C(C(=CC(=C2C)C)C)C)C

InChI

InChI=1S/C21H27NO3S/c1-8-25-21(24)18-15(6)19(22-16(18)7)17(23)10-26-20-13(4)11(2)9-12(3)14(20)5/h9,22H,8,10H2,1-7H3