ethyl 2-[[6-bromanyl-5-(5-tert-butyl-2-oxidanylidene-1,3,4-oxadiazol-3-yl)-1,3-benzothiazol-2-yl]sulfanyl]propanoate

Systemtic Name: ethyl 2-[[6-bromanyl-5-(5-tert-butyl-2-oxidanylidene-1,3,4-oxadiazol-3-yl)-1,3-benzothiazol-2-yl]sulfanyl]propanoate Openeye Name: ethyl 2-[[6-bromo-5-(5-tert-butyl-2-oxo-1,3,4-oxadiazol-3-yl)-1,3-benzothiazol-2-yl]sulfanyl]propanoate CAS Name: 2-[[6-bromo-5-(5-tert-butyl-2-oxo-1,3,4-oxadiazol-3-yl)-1,3-benzothiazol-2-yl]thio]propanoic acid ethyl ester IUPAC Name: ethyl 2-[[6-bromo-5-(5-tert-butyl-2-oxo-1,3,4-oxadiazol-3-yl)-1,3-benzothiazol-2-yl]sulfanyl]propanoate Traditional Name: 2-[[6-bromo-5-(5-tert-butyl-2-keto-1,3,4-oxadiazol-3-yl)-1,3-benzothiazol-2-yl]thio]propionic acid ethyl ester Formula: C18H20BrN3O4S2 MolecularWeight: 486.4031

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)SC1=NC2=CC(=C(C=C2S1)Br)N3C(=O)OC(=N3)C(C)(C)C

Isomeric SMILES

CCOC(=O)C(C)SC1=NC2=CC(=C(C=C2S1)Br)N3C(=O)OC(=N3)C(C)(C)C

InChI

InChI=1S/C18H20BrN3O4S2/c1-6-25-14(23)9(2)27-16-20-11-8-12(10(19)7-13(11)28-16)22-17(24)26-15(21-22)18(3,4)5/h7-9H,6H2,1-5H3