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

Systemtic Name: 3-(4-fluorophenyl)-3-[[1-(3-methylphenyl)carbonyl-3-pyridin-4-ylcarbonyl-imidazolidin-2-yl]carbonylamino]propanoic acid Openeye Name: 3-(4-fluorophenyl)-3-[[1-(3-methylbenzoyl)-3-(pyridine-4-carbonyl)imidazolidine-2-carbonyl]amino]propanoic acid CAS Name: 3-(4-fluorophenyl)-3-[[[1-[(3-methylphenyl)-oxomethyl]-3-[oxo(pyridin-4-yl)methyl]-2-imidazolidinyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-(4-fluorophenyl)-3-[[1-(3-methylbenzoyl)-3-(pyridine-4-carbonyl)imidazolidine-2-carbonyl]amino]propanoic acid Traditional Name: 3-(4-fluorophenyl)-3-[(1-isonicotinoyl-3-m-toluoyl-imidazolidine-2-carbonyl)amino]propionic acid Formula: C27H25FN4O5 MolecularWeight: 504.509603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N2CCN(C2C(=O)NC(CC(=O)O)C3=CC=C(C=C3)F)C(=O)C4=CC=NC=C4

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CCN(C2C(=O)NC(CC(=O)O)C3=CC=C(C=C3)F)C(=O)C4=CC=NC=C4

InChI

InChI=1S/C27H25FN4O5/c1-17-3-2-4-20(15-17)27(37)32-14-13-31(26(36)19-9-11-29-12-10-19)25(32)24(35)30-22(16-23(33)34)18-5-7-21(28)8-6-18/h2-12,15,22,25H,13-14,16H2,1H3,(H,30,35)(H,33,34)