3-(4-fluorophenyl)-3-[[1-(2-thiophen-2-ylethanoyl)-3-thiophen-2-ylsulfonyl-imidazolidin-2-yl]carbonylamino]propanoic acid

Systemtic Name: 3-(4-fluorophenyl)-3-[[1-(2-thiophen-2-ylethanoyl)-3-thiophen-2-ylsulfonyl-imidazolidin-2-yl]carbonylamino]propanoic acid Openeye Name: 3-(4-fluorophenyl)-3-[[1-[2-(2-thienyl)acetyl]-3-(2-thienylsulfonyl)imidazolidine-2-carbonyl]amino]propanoic acid CAS Name: 3-(4-fluorophenyl)-3-[[oxo-[1-(1-oxo-2-thiophen-2-ylethyl)-3-thiophen-2-ylsulfonyl-2-imidazolidinyl]methyl]amino]propanoic acid IUPAC Name: 3-(4-fluorophenyl)-3-[[1-(2-thiophen-2-ylacetyl)-3-thiophen-2-ylsulfonylimidazolidine-2-carbonyl]amino]propanoic acid Traditional Name: 3-(4-fluorophenyl)-3-[[1-[2-(2-thienyl)acetyl]-3-(2-thienylsulfonyl)imidazolidine-2-carbonyl]amino]propionic acid Formula: C23H22FN3O6S3 MolecularWeight: 551.630683

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(N1C(=O)CC2=CC=CS2)C(=O)NC(CC(=O)O)C3=CC=C(C=C3)F)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(C(N1C(=O)CC2=CC=CS2)C(=O)NC(CC(=O)O)C3=CC=C(C=C3)F)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C23H22FN3O6S3/c24-16-7-5-15(6-8-16)18(14-20(29)30)25-22(31)23-26(19(28)13-17-3-1-11-34-17)9-10-27(23)36(32,33)21-4-2-12-35-21/h1-8,11-12,18,23H,9-10,13-14H2,(H,25,31)(H,29,30)