ethyl 2-(1,3-benzodioxol-5-ylcarbamoylamino)-5-chloranyl-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-(1,3-benzodioxol-5-ylcarbamoylamino)-5-chloranyl-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-(1,3-benzodioxol-5-ylcarbamoylamino)-5-chloro-thiazole-4-carboxylate CAS Name: 2-[[(1,3-benzodioxol-5-ylamino)-oxomethyl]amino]-5-chloro-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(1,3-benzodioxol-5-ylcarbamoylamino)-5-chloro-1,3-thiazole-4-carboxylate Traditional Name: 2-(1,3-benzodioxol-5-ylcarbamoylamino)-5-chloro-thiazole-4-carboxylic acid ethyl ester Formula: C14H12ClN3O5S MolecularWeight: 369.78018

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=N1)NC(=O)NC2=CC3=C(C=C2)OCO3)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC(=N1)NC(=O)NC2=CC3=C(C=C2)OCO3)Cl

InChI

InChI=1S/C14H12ClN3O5S/c1-2-21-12(19)10-11(15)24-14(17-10)18-13(20)16-7-3-4-8-9(5-7)23-6-22-8/h3-5H,2,6H2,1H3,(H2,16,17,18,20)