2-[2-(1,3-benzothiazol-6-ylcarbonylamino)-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-(1,3-benzothiazol-6-ylcarbonylamino)-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-(1,3-benzothiazole-6-carbonylamino)thiazol-4-yl]acetic acid CAS Name: 2-[2-[[1,3-benzothiazol-6-yl(oxo)methyl]amino]-4-thiazolyl]acetic acid IUPAC Name: 2-[2-(1,3-benzothiazole-6-carbonylamino)-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-(1,3-benzothiazole-6-carbonylamino)thiazol-4-yl]acetic acid Formula: C13H9N3O3S2 MolecularWeight: 319.35886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)NC3=NC(=CS3)CC(=O)O)SC=N2

Isomeric SMILES

C1=CC2=C(C=C1C(=O)NC3=NC(=CS3)CC(=O)O)SC=N2

InChI

InChI=1S/C13H9N3O3S2/c17-11(18)4-8-5-20-13(15-8)16-12(19)7-1-2-9-10(3-7)21-6-14-9/h1-3,5-6H,4H2,(H,17,18)(H,15,16,19)