2-[4-[bis(fluoranyl)methyl]-6-(2-ethylpyrazol-3-yl)pyrimidin-2-yl]sulfanylethanamine

Systemtic Name: 2-[4-[bis(fluoranyl)methyl]-6-(2-ethylpyrazol-3-yl)pyrimidin-2-yl]sulfanylethanamine Openeye Name: 2-[4-(difluoromethyl)-6-(2-ethylpyrazol-3-yl)pyrimidin-2-yl]sulfanylethanamine CAS Name: 2-[[4-(difluoromethyl)-6-(2-ethyl-3-pyrazolyl)-2-pyrimidinyl]thio]ethanamine IUPAC Name: 2-[4-(difluoromethyl)-6-(2-ethylpyrazol-3-yl)pyrimidin-2-yl]sulfanylethanamine Traditional Name: 2-[[4-(difluoromethyl)-6-(2-ethylpyrazol-3-yl)pyrimidin-2-yl]thio]ethylamine Formula: C12H15F2N5S MolecularWeight: 299.342806

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=N1)C2=CC(=NC(=N2)SCCN)C(F)F

Isomeric SMILES

CCN1C(=CC=N1)C2=CC(=NC(=N2)SCCN)C(F)F

InChI

InChI=1S/C12H15F2N5S/c1-2-19-10(3-5-16-19)8-7-9(11(13)14)18-12(17-8)20-6-4-15/h3,5,7,11H,2,4,6,15H2,1H3