2-[2-[bis(fluoranyl)methylsulfanyl]benzimidazol-1-yl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-[2-[bis(fluoranyl)methylsulfanyl]benzimidazol-1-yl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[2-(difluoromethylsulfanyl)benzimidazol-1-yl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[2-(difluoromethylthio)-1-benzimidazolyl]-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-[2-(difluoromethylsulfanyl)benzimidazol-1-yl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[2-(difluoromethylthio)benzimidazol-1-yl]-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C18H18F2N6OS MolecularWeight: 404.436926

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)CN3C4=CC=CC=C4N=C3SC(F)F

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)CN3C4=CC=CC=C4N=C3SC(F)F

InChI

InChI=1S/C18H18F2N6OS/c19-16(20)28-18-23-13-4-1-2-5-14(13)26(18)12-15(27)24-8-10-25(11-9-24)17-21-6-3-7-22-17/h1-7,16H,8-12H2