3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-6-(trifluoromethyloxy)-1,3-benzothiazol-2-imine

Systemtic Name: 3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-6-(trifluoromethyloxy)-1,3-benzothiazol-2-imine Openeye Name: 3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine CAS Name: 3-[2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine IUPAC Name: 3-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-2-imine Traditional Name: [3-[2-[4-(2-pyrimidyl)piperazino]ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-2-ylidene]amine Formula: C18H19F3N6OS MolecularWeight: 424.44327

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCN2C3=C(C=C(C=C3)OC(F)(F)F)SC2=N)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCN1CCN2C3=C(C=C(C=C3)OC(F)(F)F)SC2=N)C4=NC=CC=N4

InChI

InChI=1S/C18H19F3N6OS/c19-18(20,21)28-13-2-3-14-15(12-13)29-16(22)27(14)11-8-25-6-9-26(10-7-25)17-23-4-1-5-24-17/h1-5,12,22H,6-11H2