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

Systemtic Name: [2-[(6-bromanyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl] 2-ethoxyethanoate Openeye Name: [2-[(6-bromo-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl] 2-ethoxyacetate CAS Name: 2-ethoxyacetic acid [2-[(6-bromo-1,3-benzothiazol-2-yl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(6-bromo-1,3-benzothiazol-2-yl)amino]-2-oxoethyl] 2-ethoxyacetate Traditional Name: 2-ethoxyacetic acid [2-[(6-bromo-1,3-benzothiazol-2-yl)amino]-2-keto-ethyl] ester Formula: C13H13BrN2O4S MolecularWeight: 373.22232

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC(=O)OCC(=O)NC1=NC2=C(S1)C=C(C=C2)Br

Isomeric SMILES

CCOCC(=O)OCC(=O)NC1=NC2=C(S1)C=C(C=C2)Br

InChI

InChI=1S/C13H13BrN2O4S/c1-2-19-7-12(18)20-6-11(17)16-13-15-9-4-3-8(14)5-10(9)21-13/h3-5H,2,6-7H2,1H3,(H,15,16,17)