(2-azanyl-2-oxidanylidene-ethyl) 2-(1,3-benzothiazol-2-ylsulfanyl)ethanoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 2-(1,3-benzothiazol-2-ylsulfanyl)ethanoate Openeye Name: (2-amino-2-oxo-ethyl) 2-(1,3-benzothiazol-2-ylsulfanyl)acetate CAS Name: 2-(1,3-benzothiazol-2-ylthio)acetic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 2-(1,3-benzothiazol-2-ylsulfanyl)acetate Traditional Name: 2-(1,3-benzothiazol-2-ylthio)acetic acid (2-amino-2-keto-ethyl) ester Formula: C11H10N2O3S2 MolecularWeight: 282.3387

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H10N2O3S2/c12-9(14)5-16-10(15)6-17-11-13-7-3-1-2-4-8(7)18-11/h1-4H,5-6H2,(H2,12,14)