2-[6-(2-chloroethyloxy)-1,3-benzothiazol-2-yl]-4,5-dihydro-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-[6-(2-chloroethyloxy)-1,3-benzothiazol-2-yl]-4,5-dihydro-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[6-(2-chloroethoxy)-1,3-benzothiazol-2-yl]-4,5-dihydrothiazole-4-carboxylic acid CAS Name: 2-[6-(2-chloroethoxy)-1,3-benzothiazol-2-yl]-4,5-dihydrothiazole-4-carboxylic acid IUPAC Name: 2-[6-(2-chloroethoxy)-1,3-benzothiazol-2-yl]-4,5-dihydro-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[6-(2-chloroethoxy)-1,3-benzothiazol-2-yl]-2-thiazoline-4-carboxylic acid Formula: C13H11ClN2O3S2 MolecularWeight: 342.82104

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N=C(S1)C2=NC3=C(S2)C=C(C=C3)OCCCl)C(=O)O

Isomeric SMILES

C1C(N=C(S1)C2=NC3=C(S2)C=C(C=C3)OCCCl)C(=O)O

InChI

InChI=1S/C13H11ClN2O3S2/c14-3-4-19-7-1-2-8-10(5-7)21-12(15-8)11-16-9(6-20-11)13(17)18/h1-2,5,9H,3-4,6H2,(H,17,18)