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

Systemtic Name: 3-[[1-cyclopropylcarbonyl-3-(3-methylphenyl)carbonyl-imidazolidin-2-yl]carbonylamino]-3-(4-fluorophenyl)propanoic acid Openeye Name: 3-[[1-(cyclopropanecarbonyl)-3-(3-methylbenzoyl)imidazolidine-2-carbonyl]amino]-3-(4-fluorophenyl)propanoic acid CAS Name: 3-[[[1-[cyclopropyl(oxo)methyl]-3-[(3-methylphenyl)-oxomethyl]-2-imidazolidinyl]-oxomethyl]amino]-3-(4-fluorophenyl)propanoic acid IUPAC Name: 3-[[1-(cyclopropanecarbonyl)-3-(3-methylbenzoyl)imidazolidine-2-carbonyl]amino]-3-(4-fluorophenyl)propanoic acid Traditional Name: 3-[[1-(cyclopropanecarbonyl)-3-m-toluoyl-imidazolidine-2-carbonyl]amino]-3-(4-fluorophenyl)propionic acid Formula: C25H26FN3O5 MolecularWeight: 467.489443

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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)C4CC4

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CCN(C2C(=O)NC(CC(=O)O)C3=CC=C(C=C3)F)C(=O)C4CC4

InChI

InChI=1S/C25H26FN3O5/c1-15-3-2-4-18(13-15)25(34)29-12-11-28(24(33)17-5-6-17)23(29)22(32)27-20(14-21(30)31)16-7-9-19(26)10-8-16/h2-4,7-10,13,17,20,23H,5-6,11-12,14H2,1H3,(H,27,32)(H,30,31)