[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl] 4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxylate

Systemtic Name: [2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl] 4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxylate Openeye Name: [2-(3-fluoroanilino)-2-oxo-ethyl] 4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxylate CAS Name: 4-(1-pyrrolidinylsulfonyl)-1H-pyrrole-2-carboxylic acid [2-(3-fluoroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-fluoroanilino)-2-oxoethyl] 4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxylate Traditional Name: 4-pyrrolidinosulfonyl-1H-pyrrole-2-carboxylic acid [2-(3-fluoroanilino)-2-keto-ethyl] ester Formula: C17H18FN3O5S MolecularWeight: 395.405323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CNC(=C2)C(=O)OCC(=O)NC3=CC(=CC=C3)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CNC(=C2)C(=O)OCC(=O)NC3=CC(=CC=C3)F

InChI

InChI=1S/C17H18FN3O5S/c18-12-4-3-5-13(8-12)20-16(22)11-26-17(23)15-9-14(10-19-15)27(24,25)21-6-1-2-7-21/h3-5,8-10,19H,1-2,6-7,11H2,(H,20,22)