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

Systemtic Name: 3-cyclohexyl-3-[(1-ethanoyl-3-thiophen-2-ylsulfonyl-imidazolidin-2-yl)carbonylamino]propanoic acid Openeye Name: 3-[[1-acetyl-3-(2-thienylsulfonyl)imidazolidine-2-carbonyl]amino]-3-cyclohexyl-propanoic acid CAS Name: 3-[[(1-acetyl-3-thiophen-2-ylsulfonyl-2-imidazolidinyl)-oxomethyl]amino]-3-cyclohexylpropanoic acid IUPAC Name: 3-[(1-acetyl-3-thiophen-2-ylsulfonylimidazolidine-2-carbonyl)amino]-3-cyclohexylpropanoic acid Traditional Name: 3-[[1-acetyl-3-(2-thienylsulfonyl)imidazolidine-2-carbonyl]amino]-3-cyclohexyl-propionic acid Formula: C19H27N3O6S2 MolecularWeight: 457.56418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27N3O6S2/c1-13(23)21-9-10-22(30(27,28)17-8-5-11-29-17)19(21)18(26)20-15(12-16(24)25)14-6-3-2-4-7-14/h5,8,11,14-15,19H,2-4,6-7,9-10,12H2,1H3,(H,20,26)(H,24,25)