(3-phenylpropanoylamino) 3-[2-methyl-3-(2-methyl-1-morpholin-4-yl-1-oxidanylidene-propan-2-yl)sulfonyl-imidazol-4-yl]propanoate

Systemtic Name: (3-phenylpropanoylamino) 3-[2-methyl-3-(2-methyl-1-morpholin-4-yl-1-oxidanylidene-propan-2-yl)sulfonyl-imidazol-4-yl]propanoate Openeye Name: (3-phenylpropanoylamino) 3-[3-(1,1-dimethyl-2-morpholino-2-oxo-ethyl)sulfonyl-2-methyl-imidazol-4-yl]propanoate CAS Name: 3-[2-methyl-3-[2-methyl-1-(4-morpholinyl)-1-oxopropan-2-yl]sulfonyl-4-imidazolyl]propanoic acid [(1-oxo-3-phenylpropyl)amino] ester IUPAC Name: (3-phenylpropanoylamino) 3-[2-methyl-3-(2-methyl-1-morpholin-4-yl-1-oxopropan-2-yl)sulfonylimidazol-4-yl]propanoate Traditional Name: 3-[3-(2-keto-1,1-dimethyl-2-morpholino-ethyl)sulfonyl-2-methyl-imidazol-4-yl]propionic acid (hydrocinnamoylamino) ester Formula: C24H32N4O7S MolecularWeight: 520.59848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1S(=O)(=O)C(C)(C)C(=O)N2CCOCC2)CCC(=O)ONC(=O)CCC3=CC=CC=C3

Isomeric SMILES

CC1=NC=C(N1S(=O)(=O)C(C)(C)C(=O)N2CCOCC2)CCC(=O)ONC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C24H32N4O7S/c1-18-25-17-20(10-12-22(30)35-26-21(29)11-9-19-7-5-4-6-8-19)28(18)36(32,33)24(2,3)23(31)27-13-15-34-16-14-27/h4-8,17H,9-16H2,1-3H3,(H,26,29)