ethyl 3,5-dimethyl-4-(2-thiophen-2-ylethylcarbamoyl)-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 3,5-dimethyl-4-(2-thiophen-2-ylethylcarbamoyl)-1H-pyrrole-2-carboxylate Openeye Name: ethyl 3,5-dimethyl-4-[2-(2-thienyl)ethylcarbamoyl]-1H-pyrrole-2-carboxylate CAS Name: 3,5-dimethyl-4-[oxo-(2-thiophen-2-ylethylamino)methyl]-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3,5-dimethyl-4-(2-thiophen-2-ylethylcarbamoyl)-1H-pyrrole-2-carboxylate Traditional Name: 3,5-dimethyl-4-[2-(2-thienyl)ethylcarbamoyl]-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C16H20N2O3S MolecularWeight: 320.4066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)NCCC2=CC=CS2)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)NCCC2=CC=CS2)C

InChI

InChI=1S/C16H20N2O3S/c1-4-21-16(20)14-10(2)13(11(3)18-14)15(19)17-8-7-12-6-5-9-22-12/h5-6,9,18H,4,7-8H2,1-3H3,(H,17,19)