2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-2-fluoranyl-ethanenitrile

Systemtic Name: 2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-2-fluoranyl-ethanenitrile Openeye Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-2-fluoro-acetonitrile CAS Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-2-fluoroacetonitrile IUPAC Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-2-fluoroacetonitrile Traditional Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-2-fluoro-acetonitrile Formula: C9H4ClFN2S2 MolecularWeight: 258.722863

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)N=C(S2)SC(C#N)F

Isomeric SMILES

C1=CC2=C(C=C1Cl)N=C(S2)SC(C#N)F

InChI

InChI=1S/C9H4ClFN2S2/c10-5-1-2-7-6(3-5)13-9(14-7)15-8(11)4-12/h1-3,8H