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

Systemtic Name: 3-cyclohexyl-3-[[1-[(3-methylphenyl)carbamoyl]-3-methylsulfonyl-imidazolidin-2-yl]carbonylamino]propanoic acid Openeye Name: 3-cyclohexyl-3-[[1-methylsulfonyl-3-(m-tolylcarbamoyl)imidazolidine-2-carbonyl]amino]propanoic acid CAS Name: 3-cyclohexyl-3-[[[1-[(3-methylanilino)-oxomethyl]-3-methylsulfonyl-2-imidazolidinyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-cyclohexyl-3-[[1-[(3-methylphenyl)carbamoyl]-3-methylsulfonylimidazolidine-2-carbonyl]amino]propanoic acid Traditional Name: 3-cyclohexyl-3-[[1-mesyl-3-(m-tolylcarbamoyl)imidazolidine-2-carbonyl]amino]propionic acid Formula: C22H32N4O6S MolecularWeight: 480.57768

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H32N4O6S/c1-15-7-6-10-17(13-15)23-22(30)25-11-12-26(33(2,31)32)21(25)20(29)24-18(14-19(27)28)16-8-4-3-5-9-16/h6-7,10,13,16,18,21H,3-5,8-9,11-12,14H2,1-2H3,(H,23,30)(H,24,29)(H,27,28)