3-(4-fluorophenyl)-3-[[1-(3-methylphenyl)carbonyl-3-propylsulfonyl-imidazolidin-2-yl]carbonylamino]propanoic acid

Systemtic Name: 3-(4-fluorophenyl)-3-[[1-(3-methylphenyl)carbonyl-3-propylsulfonyl-imidazolidin-2-yl]carbonylamino]propanoic acid Openeye Name: 3-(4-fluorophenyl)-3-[[1-(3-methylbenzoyl)-3-propylsulfonyl-imidazolidine-2-carbonyl]amino]propanoic acid CAS Name: 3-(4-fluorophenyl)-3-[[[1-[(3-methylphenyl)-oxomethyl]-3-propylsulfonyl-2-imidazolidinyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-(4-fluorophenyl)-3-[[1-(3-methylbenzoyl)-3-propylsulfonylimidazolidine-2-carbonyl]amino]propanoic acid Traditional Name: 3-(4-fluorophenyl)-3-[(1-m-toluoyl-3-propylsulfonyl-imidazolidine-2-carbonyl)amino]propionic acid Formula: C24H28FN3O6S MolecularWeight: 505.559023

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCN(C1C(=O)NC(CC(=O)O)C2=CC=C(C=C2)F)C(=O)C3=CC(=CC=C3)C

Isomeric SMILES

CCCS(=O)(=O)N1CCN(C1C(=O)NC(CC(=O)O)C2=CC=C(C=C2)F)C(=O)C3=CC(=CC=C3)C

InChI

InChI=1S/C24H28FN3O6S/c1-3-13-35(33,34)28-12-11-27(24(32)18-6-4-5-16(2)14-18)23(28)22(31)26-20(15-21(29)30)17-7-9-19(25)10-8-17/h4-10,14,20,23H,3,11-13,15H2,1-2H3,(H,26,31)(H,29,30)