2-[2-[(6-bromanyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylethanoic acid

Systemtic Name: 2-[2-[(6-bromanyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylethanoic acid Openeye Name: 2-[2-[(6-bromo-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl]sulfanylacetic acid CAS Name: 2-[[2-[(6-bromo-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]thio]acetic acid IUPAC Name: 2-[2-[(6-bromo-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]sulfanylacetic acid Traditional Name: 2-[[2-[(6-bromo-1,3-benzothiazol-2-yl)amino]-2-keto-ethyl]thio]acetic acid Formula: C11H9BrN2O3S2 MolecularWeight: 361.23476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)SC(=N2)NC(=O)CSCC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1Br)SC(=N2)NC(=O)CSCC(=O)O

InChI

InChI=1S/C11H9BrN2O3S2/c12-6-1-2-7-8(3-6)19-11(13-7)14-9(15)4-18-5-10(16)17/h1-3H,4-5H2,(H,16,17)(H,13,14,15)