3-(3,4-dimethoxyphenyl)-3-[(2,4-dimethyl-1,3-thiazol-5-yl)carbonylamino]propanoic acid

Systemtic Name: 3-(3,4-dimethoxyphenyl)-3-[(2,4-dimethyl-1,3-thiazol-5-yl)carbonylamino]propanoic acid Openeye Name: 3-(3,4-dimethoxyphenyl)-3-[(2,4-dimethylthiazole-5-carbonyl)amino]propanoic acid CAS Name: 3-(3,4-dimethoxyphenyl)-3-[[(2,4-dimethyl-5-thiazolyl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-(3,4-dimethoxyphenyl)-3-[(2,4-dimethyl-1,3-thiazole-5-carbonyl)amino]propanoic acid Traditional Name: 3-(3,4-dimethoxyphenyl)-3-[(2,4-dimethylthiazole-5-carbonyl)amino]propionic acid Formula: C17H20N2O5S MolecularWeight: 364.4161

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C)C(=O)NC(CC(=O)O)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC1=C(SC(=N1)C)C(=O)NC(CC(=O)O)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C17H20N2O5S/c1-9-16(25-10(2)18-9)17(22)19-12(8-15(20)21)11-5-6-13(23-3)14(7-11)24-4/h5-7,12H,8H2,1-4H3,(H,19,22)(H,20,21)