2-[5-(1,3-benzothiazol-2-yl)furan-2-yl]-2-oxidanyl-ethanenitrile

Systemtic Name: 2-[5-(1,3-benzothiazol-2-yl)furan-2-yl]-2-oxidanyl-ethanenitrile Openeye Name: 2-[5-(1,3-benzothiazol-2-yl)-2-furyl]-2-hydroxy-acetonitrile CAS Name: 2-[5-(1,3-benzothiazol-2-yl)-2-furanyl]-2-hydroxyacetonitrile IUPAC Name: 2-[5-(1,3-benzothiazol-2-yl)furan-2-yl]-2-hydroxyacetonitrile Traditional Name: 2-[5-(1,3-benzothiazol-2-yl)-2-furyl]-2-hydroxy-acetonitrile Formula: C13H8N2O2S MolecularWeight: 256.27982

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(O3)C(C#N)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(O3)C(C#N)O

InChI

InChI=1S/C13H8N2O2S/c14-7-9(16)10-5-6-11(17-10)13-15-8-3-1-2-4-12(8)18-13/h1-6,9,16H