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

Systemtic Name: 3-(4-fluorophenyl)-3-[[1-(3-methylphenyl)carbonyl-3-thiophen-2-ylcarbonyl-imidazolidin-2-yl]carbonylamino]propanoic acid Openeye Name: 3-(4-fluorophenyl)-3-[[1-(3-methylbenzoyl)-3-(thiophene-2-carbonyl)imidazolidine-2-carbonyl]amino]propanoic acid CAS Name: 3-(4-fluorophenyl)-3-[[[1-[(3-methylphenyl)-oxomethyl]-3-[oxo(thiophen-2-yl)methyl]-2-imidazolidinyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-(4-fluorophenyl)-3-[[1-(3-methylbenzoyl)-3-(thiophene-2-carbonyl)imidazolidine-2-carbonyl]amino]propanoic acid Traditional Name: 3-(4-fluorophenyl)-3-[[1-m-toluoyl-3-(2-thenoyl)imidazolidine-2-carbonyl]amino]propionic acid Formula: C26H24FN3O5S MolecularWeight: 509.549263

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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=CS4

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=CS4

InChI

InChI=1S/C26H24FN3O5S/c1-16-4-2-5-18(14-16)25(34)29-11-12-30(26(35)21-6-3-13-36-21)24(29)23(33)28-20(15-22(31)32)17-7-9-19(27)10-8-17/h2-10,13-14,20,24H,11-12,15H2,1H3,(H,28,33)(H,31,32)