3-cyclohexyl-3-[(1-morpholin-4-ylcarbonyl-3-thiophen-2-ylsulfonyl-imidazolidin-2-yl)carbonylamino]propanoic acid

Systemtic Name: 3-cyclohexyl-3-[(1-morpholin-4-ylcarbonyl-3-thiophen-2-ylsulfonyl-imidazolidin-2-yl)carbonylamino]propanoic acid Openeye Name: 3-cyclohexyl-3-[[1-(morpholine-4-carbonyl)-3-(2-thienylsulfonyl)imidazolidine-2-carbonyl]amino]propanoic acid CAS Name: 3-cyclohexyl-3-[[[1-[4-morpholinyl(oxo)methyl]-3-thiophen-2-ylsulfonyl-2-imidazolidinyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-cyclohexyl-3-[[1-(morpholine-4-carbonyl)-3-thiophen-2-ylsulfonylimidazolidine-2-carbonyl]amino]propanoic acid Traditional Name: 3-cyclohexyl-3-[[1-(morpholine-4-carbonyl)-3-(2-thienylsulfonyl)imidazolidine-2-carbonyl]amino]propionic acid Formula: C22H32N4O7S2 MolecularWeight: 528.64208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(CC(=O)O)NC(=O)C2N(CCN2S(=O)(=O)C3=CC=CS3)C(=O)N4CCOCC4

Isomeric SMILES

C1CCC(CC1)C(CC(=O)O)NC(=O)C2N(CCN2S(=O)(=O)C3=CC=CS3)C(=O)N4CCOCC4

InChI

InChI=1S/C22H32N4O7S2/c27-18(28)15-17(16-5-2-1-3-6-16)23-20(29)21-25(22(30)24-10-12-33-13-11-24)8-9-26(21)35(31,32)19-7-4-14-34-19/h4,7,14,16-17,21H,1-3,5-6,8-13,15H2,(H,23,29)(H,27,28)