[1-oxidanylidene-1-(thiophen-2-ylmethylamino)butan-2-yl] 4,5-bis(chloranyl)-1,2-thiazole-3-carboxylate

Systemtic Name: [1-oxidanylidene-1-(thiophen-2-ylmethylamino)butan-2-yl] 4,5-bis(chloranyl)-1,2-thiazole-3-carboxylate Openeye Name: 1-(2-thienylmethylcarbamoyl)propyl 4,5-dichloroisothiazole-3-carboxylate CAS Name: 4,5-dichloro-3-isothiazolecarboxylic acid [1-oxo-1-(thiophen-2-ylmethylamino)butan-2-yl] ester IUPAC Name: [1-oxo-1-(thiophen-2-ylmethylamino)butan-2-yl] 4,5-dichloro-1,2-thiazole-3-carboxylate Traditional Name: 4,5-dichloroisothiazole-3-carboxylic acid 1-(2-thenylcarbamoyl)propyl ester Formula: C13H12Cl2N2O3S2 MolecularWeight: 379.28198

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CC=CS1)OC(=O)C2=NSC(=C2Cl)Cl

Isomeric SMILES

CCC(C(=O)NCC1=CC=CS1)OC(=O)C2=NSC(=C2Cl)Cl

InChI

InChI=1S/C13H12Cl2N2O3S2/c1-2-8(12(18)16-6-7-4-3-5-21-7)20-13(19)10-9(14)11(15)22-17-10/h3-5,8H,2,6H2,1H3,(H,16,18)