ethyl 4-[2-[(4-fluorophenyl)sulfonyl-methyl-amino]ethanoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-[2-[(4-fluorophenyl)sulfonyl-methyl-amino]ethanoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-[2-[(4-fluorophenyl)sulfonyl-methyl-amino]acetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-[2-[(4-fluorophenyl)sulfonyl-methylamino]-1-oxoethyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(4-fluorophenyl)sulfonyl-methylamino]acetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-[2-[(4-fluorophenyl)sulfonyl-methyl-amino]acetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C18H21FN2O5S MolecularWeight: 396.433143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C(=O)CN(C)S(=O)(=O)C2=CC=C(C=C2)F)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C(=O)CN(C)S(=O)(=O)C2=CC=C(C=C2)F)C)C

InChI

InChI=1S/C18H21FN2O5S/c1-5-26-18(23)17-12(3)20-11(2)16(17)15(22)10-21(4)27(24,25)14-8-6-13(19)7-9-14/h6-9,20H,5,10H2,1-4H3