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

Systemtic Name: 2-[4-[bis(fluoranyl)methyl]-6-(1-methylpyrazol-4-yl)pyrimidin-2-yl]sulfanylethanamine Openeye Name: 2-[4-(difluoromethyl)-6-(1-methylpyrazol-4-yl)pyrimidin-2-yl]sulfanylethanamine CAS Name: 2-[[4-(difluoromethyl)-6-(1-methyl-4-pyrazolyl)-2-pyrimidinyl]thio]ethanamine IUPAC Name: 2-[4-(difluoromethyl)-6-(1-methylpyrazol-4-yl)pyrimidin-2-yl]sulfanylethanamine Traditional Name: 2-[[4-(difluoromethyl)-6-(1-methylpyrazol-4-yl)pyrimidin-2-yl]thio]ethylamine Formula: C11H13F2N5S MolecularWeight: 285.316226

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C2=CC(=NC(=N2)SCCN)C(F)F

Isomeric SMILES

CN1C=C(C=N1)C2=CC(=NC(=N2)SCCN)C(F)F

InChI

InChI=1S/C11H13F2N5S/c1-18-6-7(5-15-18)8-4-9(10(12)13)17-11(16-8)19-3-2-14/h4-6,10H,2-3,14H2,1H3