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

Systemtic Name: ethyl 4-[[6-bromanyl-5-(5-tert-butyl-2-oxidanylidene-1,3,4-oxadiazol-3-yl)-1,3-benzothiazol-2-yl]sulfanyl]butanoate Openeye Name: ethyl 4-[[6-bromo-5-(5-tert-butyl-2-oxo-1,3,4-oxadiazol-3-yl)-1,3-benzothiazol-2-yl]sulfanyl]butanoate CAS Name: 4-[[6-bromo-5-(5-tert-butyl-2-oxo-1,3,4-oxadiazol-3-yl)-1,3-benzothiazol-2-yl]thio]butanoic acid ethyl ester IUPAC Name: ethyl 4-[[6-bromo-5-(5-tert-butyl-2-oxo-1,3,4-oxadiazol-3-yl)-1,3-benzothiazol-2-yl]sulfanyl]butanoate Traditional Name: 4-[[6-bromo-5-(5-tert-butyl-2-keto-1,3,4-oxadiazol-3-yl)-1,3-benzothiazol-2-yl]thio]butyric acid ethyl ester Formula: C19H22BrN3O4S2 MolecularWeight: 500.42968

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCSC1=NC2=CC(=C(C=C2S1)Br)N3C(=O)OC(=N3)C(C)(C)C

Isomeric SMILES

CCOC(=O)CCCSC1=NC2=CC(=C(C=C2S1)Br)N3C(=O)OC(=N3)C(C)(C)C

InChI

InChI=1S/C19H22BrN3O4S2/c1-5-26-15(24)7-6-8-28-17-21-12-10-13(11(20)9-14(12)29-17)23-18(25)27-16(22-23)19(2,3)4/h9-10H,5-8H2,1-4H3