5-(4-butyl-3-fluoranyl-phenyl)pyrimidine-2-carbonitrile

Systemtic Name: 5-(4-butyl-3-fluoranyl-phenyl)pyrimidine-2-carbonitrile Openeye Name: 5-(4-butyl-3-fluoro-phenyl)pyrimidine-2-carbonitrile CAS Name: 5-(4-butyl-3-fluorophenyl)-2-pyrimidinecarbonitrile IUPAC Name: 5-(4-butyl-3-fluorophenyl)pyrimidine-2-carbonitrile Traditional Name: 5-(4-butyl-3-fluoro-phenyl)pyrimidine-2-carbonitrile Formula: C15H14FN3 MolecularWeight: 255.290163

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=C(C=C1)C2=CN=C(N=C2)C#N)F

Isomeric SMILES

CCCCC1=C(C=C(C=C1)C2=CN=C(N=C2)C#N)F

InChI

InChI=1S/C15H14FN3/c1-2-3-4-11-5-6-12(7-14(11)16)13-9-18-15(8-17)19-10-13/h5-7,9-10H,2-4H2,1H3