4-methyl-2-[2-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)methylamino]ethyl]-1,3-thiazole-5-carboxylic acid

Systemtic Name: 4-methyl-2-[2-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)methylamino]ethyl]-1,3-thiazole-5-carboxylic acid Openeye Name: 4-methyl-2-[2-oxo-2-[(3,4,5-trimethoxyphenyl)methylamino]ethyl]thiazole-5-carboxylic acid CAS Name: 4-methyl-2-[2-oxo-2-[(3,4,5-trimethoxyphenyl)methylamino]ethyl]-5-thiazolecarboxylic acid IUPAC Name: 4-methyl-2-[2-oxo-2-[(3,4,5-trimethoxyphenyl)methylamino]ethyl]-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[2-keto-2-[(3,4,5-trimethoxybenzyl)amino]ethyl]-4-methyl-thiazole-5-carboxylic acid Formula: C17H20N2O6S MolecularWeight: 380.4155

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)CC(=O)NCC2=CC(=C(C(=C2)OC)OC)OC)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)CC(=O)NCC2=CC(=C(C(=C2)OC)OC)OC)C(=O)O

InChI

InChI=1S/C17H20N2O6S/c1-9-16(17(21)22)26-14(19-9)7-13(20)18-8-10-5-11(23-2)15(25-4)12(6-10)24-3/h5-6H,7-8H2,1-4H3,(H,18,20)(H,21,22)