2-[4-[3-[bis(fluoranyl)methoxy]phenyl]pyrimidin-2-yl]sulfanylethanamine

Systemtic Name: 2-[4-[3-[bis(fluoranyl)methoxy]phenyl]pyrimidin-2-yl]sulfanylethanamine Openeye Name: 2-[4-[3-(difluoromethoxy)phenyl]pyrimidin-2-yl]sulfanylethanamine CAS Name: 2-[[4-[3-(difluoromethoxy)phenyl]-2-pyrimidinyl]thio]ethanamine IUPAC Name: 2-[4-[3-(difluoromethoxy)phenyl]pyrimidin-2-yl]sulfanylethanamine Traditional Name: 2-[[4-[3-(difluoromethoxy)phenyl]pyrimidin-2-yl]thio]ethylamine Formula: C13H13F2N3OS MolecularWeight: 297.323626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC(F)F)C2=NC(=NC=C2)SCCN

Isomeric SMILES

C1=CC(=CC(=C1)OC(F)F)C2=NC(=NC=C2)SCCN

InChI

InChI=1S/C13H13F2N3OS/c14-12(15)19-10-3-1-2-9(8-10)11-4-6-17-13(18-11)20-7-5-16/h1-4,6,8,12H,5,7,16H2