3-cyclohexyl-3-[[1-(4-fluorophenyl)sulfonyl-3-(phenylmethyl)sulfonyl-imidazolidin-2-yl]carbonylamino]propanoic acid

Systemtic Name: 3-cyclohexyl-3-[[1-(4-fluorophenyl)sulfonyl-3-(phenylmethyl)sulfonyl-imidazolidin-2-yl]carbonylamino]propanoic acid Openeye Name: 3-[[1-benzylsulfonyl-3-(4-fluorophenyl)sulfonyl-imidazolidine-2-carbonyl]amino]-3-cyclohexyl-propanoic acid CAS Name: 3-cyclohexyl-3-[[[1-(4-fluorophenyl)sulfonyl-3-(phenylmethyl)sulfonyl-2-imidazolidinyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[1-benzylsulfonyl-3-(4-fluorophenyl)sulfonylimidazolidine-2-carbonyl]amino]-3-cyclohexylpropanoic acid Traditional Name: 3-[[1-benzylsulfonyl-3-(4-fluorophenyl)sulfonyl-imidazolidine-2-carbonyl]amino]-3-cyclohexyl-propionic acid Formula: C26H32FN3O7S2 MolecularWeight: 581.676583

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(CC(=O)O)NC(=O)C2N(CCN2S(=O)(=O)C3=CC=C(C=C3)F)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)C(CC(=O)O)NC(=O)C2N(CCN2S(=O)(=O)C3=CC=C(C=C3)F)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C26H32FN3O7S2/c27-21-11-13-22(14-12-21)39(36,37)30-16-15-29(38(34,35)18-19-7-3-1-4-8-19)26(30)25(33)28-23(17-24(31)32)20-9-5-2-6-10-20/h1,3-4,7-8,11-14,20,23,26H,2,5-6,9-10,15-18H2,(H,28,33)(H,31,32)