tert-butyl 3-[2-(5-bromanylthiophen-2-yl)-4-oxidanylidene-1,3-thiazolidin-3-yl]propanoate

Systemtic Name: tert-butyl 3-[2-(5-bromanylthiophen-2-yl)-4-oxidanylidene-1,3-thiazolidin-3-yl]propanoate Openeye Name: tert-butyl 3-[2-(5-bromo-2-thienyl)-4-oxo-thiazolidin-3-yl]propanoate CAS Name: 3-[2-(5-bromo-2-thiophenyl)-4-oxo-3-thiazolidinyl]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[2-(5-bromothiophen-2-yl)-4-oxo-1,3-thiazolidin-3-yl]propanoate Traditional Name: 3-[2-(5-bromo-2-thienyl)-4-keto-thiazolidin-3-yl]propionic acid tert-butyl ester Formula: C14H18BrNO3S2 MolecularWeight: 392.33162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCN1C(SCC1=O)C2=CC=C(S2)Br

Isomeric SMILES

CC(C)(C)OC(=O)CCN1C(SCC1=O)C2=CC=C(S2)Br

InChI

InChI=1S/C14H18BrNO3S2/c1-14(2,3)19-12(18)6-7-16-11(17)8-20-13(16)9-4-5-10(15)21-9/h4-5,13H,6-8H2,1-3H3