3-[1-[6-oxidanylidene-4-(trifluoromethyl)pyrimidin-1-yl]propan-2-yl]-2H-thiopyran-6-carbonitrile

Systemtic Name: 3-[1-[6-oxidanylidene-4-(trifluoromethyl)pyrimidin-1-yl]propan-2-yl]-2H-thiopyran-6-carbonitrile Openeye Name: 3-[1-methyl-2-[6-oxo-4-(trifluoromethyl)pyrimidin-1-yl]ethyl]-2H-thiopyran-6-carbonitrile CAS Name: 3-[1-[6-oxo-4-(trifluoromethyl)-1-pyrimidinyl]propan-2-yl]-2H-thiopyran-6-carbonitrile IUPAC Name: 3-[1-[6-oxo-4-(trifluoromethyl)pyrimidin-1-yl]propan-2-yl]-2H-thiopyran-6-carbonitrile Traditional Name: 3-[2-[6-keto-4-(trifluoromethyl)pyrimidin-1-yl]-1-methyl-ethyl]-2H-thiopyran-6-carbonitrile Formula: C14H12F3N3OS MolecularWeight: 327.32479

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=NC(=CC1=O)C(F)(F)F)C2=CC=C(SC2)C#N

Isomeric SMILES

CC(CN1C=NC(=CC1=O)C(F)(F)F)C2=CC=C(SC2)C#N

InChI

InChI=1S/C14H12F3N3OS/c1-9(10-2-3-11(5-18)22-7-10)6-20-8-19-12(4-13(20)21)14(15,16)17/h2-4,8-9H,6-7H2,1H3