3-cyclohexyl-3-[[1-cyclohexylcarbonyl-3-[(3-methylphenyl)carbamoyl]imidazolidin-2-yl]carbonylamino]propanoic acid

Systemtic Name: 3-cyclohexyl-3-[[1-cyclohexylcarbonyl-3-[(3-methylphenyl)carbamoyl]imidazolidin-2-yl]carbonylamino]propanoic acid Openeye Name: 3-[[1-(cyclohexanecarbonyl)-3-(m-tolylcarbamoyl)imidazolidine-2-carbonyl]amino]-3-cyclohexyl-propanoic acid CAS Name: 3-cyclohexyl-3-[[[1-[cyclohexyl(oxo)methyl]-3-[(3-methylanilino)-oxomethyl]-2-imidazolidinyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[1-(cyclohexanecarbonyl)-3-[(3-methylphenyl)carbamoyl]imidazolidine-2-carbonyl]amino]-3-cyclohexylpropanoic acid Traditional Name: 3-[[1-(cyclohexanecarbonyl)-3-(m-tolylcarbamoyl)imidazolidine-2-carbonyl]amino]-3-cyclohexyl-propionic acid Formula: C28H40N4O5 MolecularWeight: 512.641

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)N2CCN(C2C(=O)NC(CC(=O)O)C3CCCCC3)C(=O)C4CCCCC4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)N2CCN(C2C(=O)NC(CC(=O)O)C3CCCCC3)C(=O)C4CCCCC4

InChI

InChI=1S/C28H40N4O5/c1-19-9-8-14-22(17-19)29-28(37)32-16-15-31(27(36)21-12-6-3-7-13-21)26(32)25(35)30-23(18-24(33)34)20-10-4-2-5-11-20/h8-9,14,17,20-21,23,26H,2-7,10-13,15-16,18H2,1H3,(H,29,37)(H,30,35)(H,33,34)