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

Systemtic Name: 3-cyclohexyl-3-[[1-(3-cyclopentylpropanoyl)-3-thiophen-2-ylsulfonyl-imidazolidin-2-yl]carbonylamino]propanoic acid Openeye Name: 3-cyclohexyl-3-[[1-(3-cyclopentylpropanoyl)-3-(2-thienylsulfonyl)imidazolidine-2-carbonyl]amino]propanoic acid CAS Name: 3-cyclohexyl-3-[[[1-(3-cyclopentyl-1-oxopropyl)-3-thiophen-2-ylsulfonyl-2-imidazolidinyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-cyclohexyl-3-[[1-(3-cyclopentylpropanoyl)-3-thiophen-2-ylsulfonylimidazolidine-2-carbonyl]amino]propanoic acid Traditional Name: 3-cyclohexyl-3-[[1-(3-cyclopentylpropanoyl)-3-(2-thienylsulfonyl)imidazolidine-2-carbonyl]amino]propionic acid Formula: C25H37N3O6S2 MolecularWeight: 539.70778

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(CC(=O)O)NC(=O)C2N(CCN2S(=O)(=O)C3=CC=CS3)C(=O)CCC4CCCC4

Isomeric SMILES

C1CCC(CC1)C(CC(=O)O)NC(=O)C2N(CCN2S(=O)(=O)C3=CC=CS3)C(=O)CCC4CCCC4

InChI

InChI=1S/C25H37N3O6S2/c29-21(13-12-18-7-4-5-8-18)27-14-15-28(36(33,34)23-11-6-16-35-23)25(27)24(32)26-20(17-22(30)31)19-9-2-1-3-10-19/h6,11,16,18-20,25H,1-5,7-10,12-15,17H2,(H,26,32)(H,30,31)