1-[4-(cyclopentylamino)-2-methylsulfanyl-pyrimidin-5-yl]-2,2,2-tris(fluoranyl)ethanol

Systemtic Name: 1-[4-(cyclopentylamino)-2-methylsulfanyl-pyrimidin-5-yl]-2,2,2-tris(fluoranyl)ethanol Openeye Name: 1-[4-(cyclopentylamino)-2-methylsulfanyl-pyrimidin-5-yl]-2,2,2-trifluoro-ethanol CAS Name: 1-[4-(cyclopentylamino)-2-(methylthio)-5-pyrimidinyl]-2,2,2-trifluoroethanol IUPAC Name: 1-[4-(cyclopentylamino)-2-methylsulfanylpyrimidin-5-yl]-2,2,2-trifluoroethanol Traditional Name: 1-[4-(cyclopentylamino)-2-(methylthio)pyrimidin-5-yl]-2,2,2-trifluoro-ethanol Formula: C12H16F3N3OS MolecularWeight: 307.33515

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)NC2CCCC2)C(C(F)(F)F)O

Isomeric SMILES

CSC1=NC=C(C(=N1)NC2CCCC2)C(C(F)(F)F)O

InChI

InChI=1S/C12H16F3N3OS/c1-20-11-16-6-8(9(19)12(13,14)15)10(18-11)17-7-4-2-3-5-7/h6-7,9,19H,2-5H2,1H3,(H,16,17,18)