2-[[4-piperidin-1-yl-5-[2,2,2-tris(fluoranyl)ethoxy]pyrimidin-2-yl]methylsulfinyl]-1H-thieno[3,4-d]imidazole

Systemtic Name: 2-[[4-piperidin-1-yl-5-[2,2,2-tris(fluoranyl)ethoxy]pyrimidin-2-yl]methylsulfinyl]-1H-thieno[3,4-d]imidazole Openeye Name: 2-[[4-(1-piperidyl)-5-(2,2,2-trifluoroethoxy)pyrimidin-2-yl]methylsulfinyl]-1H-thieno[3,4-d]imidazole CAS Name: 2-[[4-(1-piperidinyl)-5-(2,2,2-trifluoroethoxy)-2-pyrimidinyl]methylsulfinyl]-1H-thieno[3,4-d]imidazole IUPAC Name: 2-[[4-piperidin-1-yl-5-(2,2,2-trifluoroethoxy)pyrimidin-2-yl]methylsulfinyl]-1H-thieno[3,4-d]imidazole Traditional Name: 2-[[4-piperidino-5-(2,2,2-trifluoroethoxy)pyrimidin-2-yl]methylsulfinyl]-1H-thien[3,4-d]imidazole Formula: C17H18F3N5O2S2 MolecularWeight: 445.48233

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC(=NC=C2OCC(F)(F)F)CS(=O)C3=NC4=CSC=C4N3

Isomeric SMILES

C1CCN(CC1)C2=NC(=NC=C2OCC(F)(F)F)CS(=O)C3=NC4=CSC=C4N3

InChI

InChI=1S/C17H18F3N5O2S2/c18-17(19,20)10-27-13-6-21-14(24-15(13)25-4-2-1-3-5-25)9-29(26)16-22-11-7-28-8-12(11)23-16/h6-8H,1-5,9-10H2,(H,22,23)