2-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoylamino]ethanoic acid

Systemtic Name: 2-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoylamino]ethanoic acid Openeye Name: 2-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino]acetic acid CAS Name: 2-[[2-(1,3-benzothiazol-2-ylthio)-1-oxoethyl]amino]acetic acid IUPAC Name: 2-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino]acetic acid Traditional Name: 2-[[2-(1,3-benzothiazol-2-ylthio)acetyl]amino]acetic acid Formula: C11H10N2O3S2 MolecularWeight: 282.3387

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCC(=O)NCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCC(=O)NCC(=O)O

InChI

InChI=1S/C11H10N2O3S2/c14-9(12-5-10(15)16)6-17-11-13-7-3-1-2-4-8(7)18-11/h1-4H,5-6H2,(H,12,14)(H,15,16)