3-(2-pyridin-4-ylsulfinylethyl)-6-(trifluoromethyloxy)-1,3-benzothiazol-2-imine

Systemtic Name: 3-(2-pyridin-4-ylsulfinylethyl)-6-(trifluoromethyloxy)-1,3-benzothiazol-2-imine Openeye Name: 3-[2-(4-pyridylsulfinyl)ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine CAS Name: 3-(2-pyridin-4-ylsulfinylethyl)-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine IUPAC Name: 3-(2-pyridin-4-ylsulfinylethyl)-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine Traditional Name: [3-[2-(4-pyridylsulfinyl)ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-2-ylidene]amine Formula: C15H12F3N3O2S2 MolecularWeight: 387.39989

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1OC(F)(F)F)SC(=N)N2CCS(=O)C3=CC=NC=C3

Isomeric SMILES

C1=CC2=C(C=C1OC(F)(F)F)SC(=N)N2CCS(=O)C3=CC=NC=C3

InChI

InChI=1S/C15H12F3N3O2S2/c16-15(17,18)23-10-1-2-12-13(9-10)24-14(19)21(12)7-8-25(22)11-3-5-20-6-4-11/h1-6,9,19H,7-8H2