3-cyclohexyl-3-[(1-methylsulfonyl-3-thiophen-2-ylsulfonyl-imidazolidin-2-yl)carbonylamino]propanoic acid

Systemtic Name: 3-cyclohexyl-3-[(1-methylsulfonyl-3-thiophen-2-ylsulfonyl-imidazolidin-2-yl)carbonylamino]propanoic acid Openeye Name: 3-cyclohexyl-3-[[1-methylsulfonyl-3-(2-thienylsulfonyl)imidazolidine-2-carbonyl]amino]propanoic acid CAS Name: 3-cyclohexyl-3-[[(1-methylsulfonyl-3-thiophen-2-ylsulfonyl-2-imidazolidinyl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-cyclohexyl-3-[(1-methylsulfonyl-3-thiophen-2-ylsulfonylimidazolidine-2-carbonyl)amino]propanoic acid Traditional Name: 3-cyclohexyl-3-[[1-mesyl-3-(2-thienylsulfonyl)imidazolidine-2-carbonyl]amino]propionic acid Formula: C18H27N3O7S3 MolecularWeight: 493.61788

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(C1C(=O)NC(CC(=O)O)C2CCCCC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CS(=O)(=O)N1CCN(C1C(=O)NC(CC(=O)O)C2CCCCC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C18H27N3O7S3/c1-30(25,26)20-9-10-21(31(27,28)16-8-5-11-29-16)18(20)17(24)19-14(12-15(22)23)13-6-3-2-4-7-13/h5,8,11,13-14,18H,2-4,6-7,9-10,12H2,1H3,(H,19,24)(H,22,23)