3-cyclohexyl-3-[[1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3-thiophen-2-ylsulfonyl-imidazolidin-2-yl]carbonylamino]propanoic acid

Systemtic Name: 3-cyclohexyl-3-[[1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3-thiophen-2-ylsulfonyl-imidazolidin-2-yl]carbonylamino]propanoic acid Openeye Name: 3-cyclohexyl-3-[[1-(3,5-dimethylisoxazol-4-yl)sulfonyl-3-(2-thienylsulfonyl)imidazolidine-2-carbonyl]amino]propanoic acid CAS Name: 3-cyclohexyl-3-[[[1-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-3-thiophen-2-ylsulfonyl-2-imidazolidinyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-cyclohexyl-3-[[1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-3-thiophen-2-ylsulfonylimidazolidine-2-carbonyl]amino]propanoic acid Traditional Name: 3-cyclohexyl-3-[[1-(3,5-dimethylisoxazol-4-yl)sulfonyl-3-(2-thienylsulfonyl)imidazolidine-2-carbonyl]amino]propionic acid Formula: C22H30N4O8S3 MolecularWeight: 574.6906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCN(C2C(=O)NC(CC(=O)O)C3CCCCC3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCN(C2C(=O)NC(CC(=O)O)C3CCCCC3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C22H30N4O8S3/c1-14-20(15(2)34-24-14)37(32,33)26-11-10-25(36(30,31)19-9-6-12-35-19)22(26)21(29)23-17(13-18(27)28)16-7-4-3-5-8-16/h6,9,12,16-17,22H,3-5,7-8,10-11,13H2,1-2H3,(H,23,29)(H,27,28)