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

Systemtic Name: 3-cyclohexyl-3-[[1-ethanoyl-3-(phenylmethyl)sulfonyl-imidazolidin-2-yl]carbonylamino]propanoic acid Openeye Name: 3-[(1-acetyl-3-benzylsulfonyl-imidazolidine-2-carbonyl)amino]-3-cyclohexyl-propanoic acid CAS Name: 3-[[[1-acetyl-3-(phenylmethyl)sulfonyl-2-imidazolidinyl]-oxomethyl]amino]-3-cyclohexylpropanoic acid IUPAC Name: 3-[(1-acetyl-3-benzylsulfonylimidazolidine-2-carbonyl)amino]-3-cyclohexylpropanoic acid Traditional Name: 3-[(1-acetyl-3-benzylsulfonyl-imidazolidine-2-carbonyl)amino]-3-cyclohexyl-propionic acid Formula: C22H31N3O6S MolecularWeight: 465.56304

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H31N3O6S/c1-16(26)24-12-13-25(32(30,31)15-17-8-4-2-5-9-17)22(24)21(29)23-19(14-20(27)28)18-10-6-3-7-11-18/h2,4-5,8-9,18-19,22H,3,6-7,10-15H2,1H3,(H,23,29)(H,27,28)