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

Systemtic Name: 2-[1-[bis(fluoranyl)methyl]benzimidazol-2-yl]sulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[1-(difluoromethyl)benzimidazol-2-yl]sulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[[1-(difluoromethyl)-2-benzimidazolyl]thio]-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-[1-(difluoromethyl)benzimidazol-2-yl]sulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[[1-(difluoromethyl)benzimidazol-2-yl]thio]-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)CSC3=NC4=CC=CC=C4N3C(F)F

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)CSC3=NC4=CC=CC=C4N3C(F)F

InChI

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