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

Systemtic Name: 3-cyclohexyl-3-[(1-propylsulfonyl-3-thiophen-2-ylsulfonyl-imidazolidin-2-yl)carbonylamino]propanoic acid Openeye Name: 3-cyclohexyl-3-[[1-propylsulfonyl-3-(2-thienylsulfonyl)imidazolidine-2-carbonyl]amino]propanoic acid CAS Name: 3-cyclohexyl-3-[[oxo-(1-propylsulfonyl-3-thiophen-2-ylsulfonyl-2-imidazolidinyl)methyl]amino]propanoic acid IUPAC Name: 3-cyclohexyl-3-[(1-propylsulfonyl-3-thiophen-2-ylsulfonylimidazolidine-2-carbonyl)amino]propanoic acid Traditional Name: 3-cyclohexyl-3-[[1-propylsulfonyl-3-(2-thienylsulfonyl)imidazolidine-2-carbonyl]amino]propionic acid Formula: C20H31N3O7S3 MolecularWeight: 521.67104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCN(C1C(=O)NC(CC(=O)O)C2CCCCC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CCCS(=O)(=O)N1CCN(C1C(=O)NC(CC(=O)O)C2CCCCC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C20H31N3O7S3/c1-2-13-32(27,28)22-10-11-23(33(29,30)18-9-6-12-31-18)20(22)19(26)21-16(14-17(24)25)15-7-4-3-5-8-15/h6,9,12,15-16,20H,2-5,7-8,10-11,13-14H2,1H3,(H,21,26)(H,24,25)