4-azanyl-2-[2-(2-fluoranylphenoxy)ethylsulfanyl]pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-2-[2-(2-fluoranylphenoxy)ethylsulfanyl]pyrimidine-5-carbonitrile Openeye Name: 4-amino-2-[2-(2-fluorophenoxy)ethylsulfanyl]pyrimidine-5-carbonitrile CAS Name: 4-amino-2-[2-(2-fluorophenoxy)ethylthio]-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-2-[2-(2-fluorophenoxy)ethylsulfanyl]pyrimidine-5-carbonitrile Traditional Name: 4-amino-2-[2-(2-fluorophenoxy)ethylthio]pyrimidine-5-carbonitrile Formula: C13H11FN4OS MolecularWeight: 290.316043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OCCSC2=NC=C(C(=N2)N)C#N)F

Isomeric SMILES

C1=CC=C(C(=C1)OCCSC2=NC=C(C(=N2)N)C#N)F

InChI

InChI=1S/C13H11FN4OS/c14-10-3-1-2-4-11(10)19-5-6-20-13-17-8-9(7-15)12(16)18-13/h1-4,8H,5-6H2,(H2,16,17,18)