1-(1-adamantyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanone

Systemtic Name: 1-(1-adamantyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanone Openeye Name: 1-(1-adamantyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanone CAS Name: 1-(1-adamantyl)-2-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]ethanone IUPAC Name: 1-(1-adamantyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylethanone Traditional Name: 1-(1-adamantyl)-2-[[4-(trifluoromethyl)pyrimidin-2-yl]thio]ethanone Formula: C17H19F3N2OS MolecularWeight: 356.40577

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)CSC4=NC=CC(=N4)C(F)(F)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)CSC4=NC=CC(=N4)C(F)(F)F

InChI

InChI=1S/C17H19F3N2OS/c18-17(19,20)13-1-2-21-15(22-13)24-9-14(23)16-6-10-3-11(7-16)5-12(4-10)8-16/h1-2,10-12H,3-9H2