3-[2-(pyridin-2-ylmethylsulfanyl)ethyl]-6-(trifluoromethyloxy)-1,3-benzothiazol-2-imine

Systemtic Name: 3-[2-(pyridin-2-ylmethylsulfanyl)ethyl]-6-(trifluoromethyloxy)-1,3-benzothiazol-2-imine Openeye Name: 3-[2-(2-pyridylmethylsulfanyl)ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine CAS Name: 3-[2-(2-pyridinylmethylthio)ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine IUPAC Name: 3-[2-(pyridin-2-ylmethylsulfanyl)ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine Traditional Name: [3-[2-(2-pyridylmethylthio)ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-2-ylidene]amine Formula: C16H14F3N3OS2 MolecularWeight: 385.42707

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CSCCN2C3=C(C=C(C=C3)OC(F)(F)F)SC2=N

Isomeric SMILES

C1=CC=NC(=C1)CSCCN2C3=C(C=C(C=C3)OC(F)(F)F)SC2=N

InChI

InChI=1S/C16H14F3N3OS2/c17-16(18,19)23-12-4-5-13-14(9-12)25-15(20)22(13)7-8-24-10-11-3-1-2-6-21-11/h1-6,9,20H,7-8,10H2