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

Systemtic Name: 2-[(3,4-diethoxyphenyl)methylamino]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[(3,4-diethoxyphenyl)methylamino]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[(3,4-diethoxyphenyl)methylamino]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[(3,4-diethoxyphenyl)methylamino]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[(3,4-diethoxybenzyl)amino]-4-methyl-thiazole-5-carboxylic acid Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC2=NC(=C(S2)C(=O)O)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC2=NC(=C(S2)C(=O)O)C)OCC

InChI

InChI=1S/C16H20N2O4S/c1-4-21-12-7-6-11(8-13(12)22-5-2)9-17-16-18-10(3)14(23-16)15(19)20/h6-8H,4-5,9H2,1-3H3,(H,17,18)(H,19,20)