2-[[3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]methylamino]-4-methyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[[3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]methylamino]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[[3-ethoxy-4-(p-tolylmethoxy)phenyl]methylamino]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[[3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]methylamino]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[[3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]methylamino]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[[3-ethoxy-4-(4-methylbenzyl)oxy-benzyl]amino]-4-methyl-thiazole-5-carboxylic acid Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CNC2=NC(=C(S2)C(=O)O)C)OCC3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)CNC2=NC(=C(S2)C(=O)O)C)OCC3=CC=C(C=C3)C

InChI

InChI=1S/C22H24N2O4S/c1-4-27-19-11-17(12-23-22-24-15(3)20(29-22)21(25)26)9-10-18(19)28-13-16-7-5-14(2)6-8-16/h5-11H,4,12-13H2,1-3H3,(H,23,24)(H,25,26)