2-[1-[2,4-bis(fluoranyl)phenyl]-2-chloranyl-1-oxidanyl-ethyl]-1,3-benzothiazole-6-carbonitrile

Systemtic Name: 2-[1-[2,4-bis(fluoranyl)phenyl]-2-chloranyl-1-oxidanyl-ethyl]-1,3-benzothiazole-6-carbonitrile Openeye Name: 2-[2-chloro-1-(2,4-difluorophenyl)-1-hydroxy-ethyl]-1,3-benzothiazole-6-carbonitrile CAS Name: 2-[2-chloro-1-(2,4-difluorophenyl)-1-hydroxyethyl]-1,3-benzothiazole-6-carbonitrile IUPAC Name: 2-[2-chloro-1-(2,4-difluorophenyl)-1-hydroxyethyl]-1,3-benzothiazole-6-carbonitrile Traditional Name: 2-[2-chloro-1-(2,4-difluorophenyl)-1-hydroxy-ethyl]-1,3-benzothiazole-6-carbonitrile Formula: C16H9ClF2N2OS MolecularWeight: 350.770266

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C#N)SC(=N2)C(CCl)(C3=C(C=C(C=C3)F)F)O

Isomeric SMILES

C1=CC2=C(C=C1C#N)SC(=N2)C(CCl)(C3=C(C=C(C=C3)F)F)O

InChI

InChI=1S/C16H9ClF2N2OS/c17-8-16(22,11-3-2-10(18)6-12(11)19)15-21-13-4-1-9(7-20)5-14(13)23-15/h1-6,22H,8H2