3-cyclohexyl-3-[[1-(phenylmethyl)sulfonyl-3-propylsulfonyl-imidazolidin-2-yl]carbonylamino]propanoic acid

Systemtic Name: 3-cyclohexyl-3-[[1-(phenylmethyl)sulfonyl-3-propylsulfonyl-imidazolidin-2-yl]carbonylamino]propanoic acid Openeye Name: 3-[(1-benzylsulfonyl-3-propylsulfonyl-imidazolidine-2-carbonyl)amino]-3-cyclohexyl-propanoic acid CAS Name: 3-cyclohexyl-3-[[oxo-[1-(phenylmethyl)sulfonyl-3-propylsulfonyl-2-imidazolidinyl]methyl]amino]propanoic acid IUPAC Name: 3-[(1-benzylsulfonyl-3-propylsulfonylimidazolidine-2-carbonyl)amino]-3-cyclohexylpropanoic acid Traditional Name: 3-[(1-benzylsulfonyl-3-propylsulfonyl-imidazolidine-2-carbonyl)amino]-3-cyclohexyl-propionic acid Formula: C23H35N3O7S2 MolecularWeight: 529.6699

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCN(C1C(=O)NC(CC(=O)O)C2CCCCC2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CCCS(=O)(=O)N1CCN(C1C(=O)NC(CC(=O)O)C2CCCCC2)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C23H35N3O7S2/c1-2-15-34(30,31)25-13-14-26(35(32,33)17-18-9-5-3-6-10-18)23(25)22(29)24-20(16-21(27)28)19-11-7-4-8-12-19/h3,5-6,9-10,19-20,23H,2,4,7-8,11-17H2,1H3,(H,24,29)(H,27,28)