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

Systemtic Name: 3-cyclohexyl-3-[[1-(3-methylphenyl)carbonyl-3-pyridin-4-ylcarbonyl-imidazolidin-2-yl]carbonylamino]propanoic acid Openeye Name: 3-cyclohexyl-3-[[1-(3-methylbenzoyl)-3-(pyridine-4-carbonyl)imidazolidine-2-carbonyl]amino]propanoic acid CAS Name: 3-cyclohexyl-3-[[[1-[(3-methylphenyl)-oxomethyl]-3-[oxo(pyridin-4-yl)methyl]-2-imidazolidinyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-cyclohexyl-3-[[1-(3-methylbenzoyl)-3-(pyridine-4-carbonyl)imidazolidine-2-carbonyl]amino]propanoic acid Traditional Name: 3-cyclohexyl-3-[(1-isonicotinoyl-3-m-toluoyl-imidazolidine-2-carbonyl)amino]propionic acid Formula: C27H32N4O5 MolecularWeight: 492.56678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N2CCN(C2C(=O)NC(CC(=O)O)C3CCCCC3)C(=O)C4=CC=NC=C4

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CCN(C2C(=O)NC(CC(=O)O)C3CCCCC3)C(=O)C4=CC=NC=C4

InChI

InChI=1S/C27H32N4O5/c1-18-6-5-9-21(16-18)27(36)31-15-14-30(26(35)20-10-12-28-13-11-20)25(31)24(34)29-22(17-23(32)33)19-7-3-2-4-8-19/h5-6,9-13,16,19,22,25H,2-4,7-8,14-15,17H2,1H3,(H,29,34)(H,32,33)