3-cyclohexyl-3-[[1-[(3-fluorophenyl)carbamoyl]-3-propylsulfonyl-imidazolidin-2-yl]carbonylamino]propanoic acid

Systemtic Name: 3-cyclohexyl-3-[[1-[(3-fluorophenyl)carbamoyl]-3-propylsulfonyl-imidazolidin-2-yl]carbonylamino]propanoic acid Openeye Name: 3-cyclohexyl-3-[[1-[(3-fluorophenyl)carbamoyl]-3-propylsulfonyl-imidazolidine-2-carbonyl]amino]propanoic acid CAS Name: 3-cyclohexyl-3-[[[1-[(3-fluoroanilino)-oxomethyl]-3-propylsulfonyl-2-imidazolidinyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-cyclohexyl-3-[[1-[(3-fluorophenyl)carbamoyl]-3-propylsulfonylimidazolidine-2-carbonyl]amino]propanoic acid Traditional Name: 3-cyclohexyl-3-[[1-[(3-fluorophenyl)carbamoyl]-3-propylsulfonyl-imidazolidine-2-carbonyl]amino]propionic acid Formula: C23H33FN4O6S MolecularWeight: 512.594723

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCN(C1C(=O)NC(CC(=O)O)C2CCCCC2)C(=O)NC3=CC(=CC=C3)F

Isomeric SMILES

CCCS(=O)(=O)N1CCN(C1C(=O)NC(CC(=O)O)C2CCCCC2)C(=O)NC3=CC(=CC=C3)F

InChI

InChI=1S/C23H33FN4O6S/c1-2-13-35(33,34)28-12-11-27(23(32)25-18-10-6-9-17(24)14-18)22(28)21(31)26-19(15-20(29)30)16-7-4-3-5-8-16/h6,9-10,14,16,19,22H,2-5,7-8,11-13,15H2,1H3,(H,25,32)(H,26,31)(H,29,30)