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

Systemtic Name: 4-methyl-2-[2-oxidanylidene-2-[2-(4-phenylphenoxy)ethylamino]ethyl]-1,3-thiazole-5-carboxylic acid Openeye Name: 4-methyl-2-[2-oxo-2-[2-(4-phenylphenoxy)ethylamino]ethyl]thiazole-5-carboxylic acid CAS Name: 4-methyl-2-[2-oxo-2-[2-(4-phenylphenoxy)ethylamino]ethyl]-5-thiazolecarboxylic acid IUPAC Name: 4-methyl-2-[2-oxo-2-[2-(4-phenylphenoxy)ethylamino]ethyl]-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[2-keto-2-[2-(4-phenylphenoxy)ethylamino]ethyl]-4-methyl-thiazole-5-carboxylic acid Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)CC(=O)NCCOC2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)CC(=O)NCCOC2=CC=C(C=C2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C21H20N2O4S/c1-14-20(21(25)26)28-19(23-14)13-18(24)22-11-12-27-17-9-7-16(8-10-17)15-5-3-2-4-6-15/h2-10H,11-13H2,1H3,(H,22,24)(H,25,26)