ethyl 4-[(4-fluorophenyl)methyl-(pyridin-3-ylmethyl)sulfamoyl]-1,2,5-trimethyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-[(4-fluorophenyl)methyl-(pyridin-3-ylmethyl)sulfamoyl]-1,2,5-trimethyl-pyrrole-3-carboxylate Openeye Name: ethyl 4-[(4-fluorophenyl)methyl-(3-pyridylmethyl)sulfamoyl]-1,2,5-trimethyl-pyrrole-3-carboxylate CAS Name: 4-[(4-fluorophenyl)methyl-(3-pyridinylmethyl)sulfamoyl]-1,2,5-trimethyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-fluorophenyl)methyl-(pyridin-3-ylmethyl)sulfamoyl]-1,2,5-trimethylpyrrole-3-carboxylate Traditional Name: 4-[(4-fluorobenzyl)-(3-pyridylmethyl)sulfamoyl]-1,2,5-trimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C23H26FN3O4S MolecularWeight: 459.533643

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1S(=O)(=O)N(CC2=CC=C(C=C2)F)CC3=CN=CC=C3)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1S(=O)(=O)N(CC2=CC=C(C=C2)F)CC3=CN=CC=C3)C)C)C

InChI

InChI=1S/C23H26FN3O4S/c1-5-31-23(28)21-16(2)26(4)17(3)22(21)32(29,30)27(15-19-7-6-12-25-13-19)14-18-8-10-20(24)11-9-18/h6-13H,5,14-15H2,1-4H3