5-(2-methoxyethylcarbamoyl)-3-[(3-methoxyphenyl)sulfanylmethyl]-1,2-oxazole-4-carboxylic acid

Systemtic Name: 5-(2-methoxyethylcarbamoyl)-3-[(3-methoxyphenyl)sulfanylmethyl]-1,2-oxazole-4-carboxylic acid Openeye Name: 5-(2-methoxyethylcarbamoyl)-3-[(3-methoxyphenyl)sulfanylmethyl]isoxazole-4-carboxylic acid CAS Name: 5-[(2-methoxyethylamino)-oxomethyl]-3-[[(3-methoxyphenyl)thio]methyl]-4-isoxazolecarboxylic acid IUPAC Name: 5-(2-methoxyethylcarbamoyl)-3-[(3-methoxyphenyl)sulfanylmethyl]-1,2-oxazole-4-carboxylic acid Traditional Name: 5-(2-methoxyethylcarbamoyl)-3-[[(3-methoxyphenyl)thio]methyl]isoxazole-4-carboxylic acid Formula: C16H18N2O6S MolecularWeight: 366.38892

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)C1=C(C(=NO1)CSC2=CC=CC(=C2)OC)C(=O)O

Isomeric SMILES

COCCNC(=O)C1=C(C(=NO1)CSC2=CC=CC(=C2)OC)C(=O)O

InChI

InChI=1S/C16H18N2O6S/c1-22-7-6-17-15(19)14-13(16(20)21)12(18-24-14)9-25-11-5-3-4-10(8-11)23-2/h3-5,8H,6-7,9H2,1-2H3,(H,17,19)(H,20,21)