3-(6-chloranylhexoxy)-5-(dimethylcarbamoylamino)-1,2-thiazole-4-carboxylic acid

Systemtic Name: 3-(6-chloranylhexoxy)-5-(dimethylcarbamoylamino)-1,2-thiazole-4-carboxylic acid Openeye Name: 3-(6-chlorohexoxy)-5-(dimethylcarbamoylamino)isothiazole-4-carboxylic acid CAS Name: 3-(6-chlorohexoxy)-5-[[dimethylamino(oxo)methyl]amino]-4-isothiazolecarboxylic acid IUPAC Name: 3-(6-chlorohexoxy)-5-(dimethylcarbamoylamino)-1,2-thiazole-4-carboxylic acid Traditional Name: 3-(6-chlorohexoxy)-5-(dimethylcarbamoylamino)isothiazole-4-carboxylic acid Formula: C13H20ClN3O4S MolecularWeight: 349.8336

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)NC1=C(C(=NS1)OCCCCCCCl)C(=O)O

Isomeric SMILES

CN(C)C(=O)NC1=C(C(=NS1)OCCCCCCCl)C(=O)O

InChI

InChI=1S/C13H20ClN3O4S/c1-17(2)13(20)15-11-9(12(18)19)10(16-22-11)21-8-6-4-3-5-7-14/h3-8H2,1-2H3,(H,15,20)(H,18,19)