dibenzofuran-2-yl 4-(1,3-benzothiazol-2-ylsulfanyl)butanoate

Systemtic Name: dibenzofuran-2-yl 4-(1,3-benzothiazol-2-ylsulfanyl)butanoate Openeye Name: dibenzofuran-2-yl 4-(1,3-benzothiazol-2-ylsulfanyl)butanoate CAS Name: 4-(1,3-benzothiazol-2-ylthio)butanoic acid 2-dibenzofuranyl ester IUPAC Name: dibenzofuran-2-yl 4-(1,3-benzothiazol-2-ylsulfanyl)butanoate Traditional Name: 4-(1,3-benzothiazol-2-ylthio)butyric acid dibenzofuran-2-yl ester Formula: C23H17NO3S2 MolecularWeight: 419.51598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(O2)C=CC(=C3)OC(=O)CCCSC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(O2)C=CC(=C3)OC(=O)CCCSC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H17NO3S2/c25-22(10-5-13-28-23-24-18-7-2-4-9-21(18)29-23)26-15-11-12-20-17(14-15)16-6-1-3-8-19(16)27-20/h1-4,6-9,11-12,14H,5,10,13H2