2-[4-[bis(fluoranyl)methyl]-6-(1-ethylpyrazol-3-yl)pyrimidin-2-yl]sulfanylethanamine

Systemtic Name: 2-[4-[bis(fluoranyl)methyl]-6-(1-ethylpyrazol-3-yl)pyrimidin-2-yl]sulfanylethanamine Openeye Name: 2-[4-(difluoromethyl)-6-(1-ethylpyrazol-3-yl)pyrimidin-2-yl]sulfanylethanamine CAS Name: 2-[[4-(difluoromethyl)-6-(1-ethyl-3-pyrazolyl)-2-pyrimidinyl]thio]ethanamine IUPAC Name: 2-[4-(difluoromethyl)-6-(1-ethylpyrazol-3-yl)pyrimidin-2-yl]sulfanylethanamine Traditional Name: 2-[[4-(difluoromethyl)-6-(1-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/c1-2-19-5-3-8(18-19)9-7-10(11(13)14)17-12(16-9)20-6-4-15/h3,5,7,11H,2,4,6,15H2,1H3