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

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)ethylamino]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[2-(3,4-dimethoxyphenyl)ethylamino]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[2-(3,4-dimethoxyphenyl)ethylamino]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)ethylamino]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-(homoveratrylamino)-4-methyl-thiazole-5-carboxylic acid Formula: C15H18N2O4S MolecularWeight: 322.37942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NCCC2=CC(=C(C=C2)OC)OC)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)NCCC2=CC(=C(C=C2)OC)OC)C(=O)O

InChI

InChI=1S/C15H18N2O4S/c1-9-13(14(18)19)22-15(17-9)16-7-6-10-4-5-11(20-2)12(8-10)21-3/h4-5,8H,6-7H2,1-3H3,(H,16,17)(H,18,19)