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

Systemtic Name: 3-(4-fluorophenyl)-3-[(1-thiophen-2-ylcarbonyl-3-thiophen-2-ylsulfonyl-imidazolidin-2-yl)carbonylamino]propanoic acid Openeye Name: 3-(4-fluorophenyl)-3-[[1-(2-thienylsulfonyl)-3-(thiophene-2-carbonyl)imidazolidine-2-carbonyl]amino]propanoic acid CAS Name: 3-(4-fluorophenyl)-3-[[oxo-[1-[oxo(thiophen-2-yl)methyl]-3-thiophen-2-ylsulfonyl-2-imidazolidinyl]methyl]amino]propanoic acid IUPAC Name: 3-(4-fluorophenyl)-3-[[1-(thiophene-2-carbonyl)-3-thiophen-2-ylsulfonylimidazolidine-2-carbonyl]amino]propanoic acid Traditional Name: 3-(4-fluorophenyl)-3-[[1-(2-thenoyl)-3-(2-thienylsulfonyl)imidazolidine-2-carbonyl]amino]propionic acid Formula: C22H20FN3O6S3 MolecularWeight: 537.604103

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(N1C(=O)C2=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)C2=CC=CS2)C(=O)NC(CC(=O)O)C3=CC=C(C=C3)F)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C22H20FN3O6S3/c23-15-7-5-14(6-8-15)16(13-18(27)28)24-20(29)21-25(22(30)17-3-1-11-33-17)9-10-26(21)35(31,32)19-4-2-12-34-19/h1-8,11-12,16,21H,9-10,13H2,(H,24,29)(H,27,28)