4-fluoranyl-2-[4-(5-pentyl-1,3-dioxan-2-yl)cyclohexyl]pyrimidine-5-carbonitrile

Systemtic Name: 4-fluoranyl-2-[4-(5-pentyl-1,3-dioxan-2-yl)cyclohexyl]pyrimidine-5-carbonitrile Openeye Name: 4-fluoro-2-[4-(5-pentyl-1,3-dioxan-2-yl)cyclohexyl]pyrimidine-5-carbonitrile CAS Name: 4-fluoro-2-[4-(5-pentyl-1,3-dioxan-2-yl)cyclohexyl]-5-pyrimidinecarbonitrile IUPAC Name: 4-fluoro-2-[4-(5-pentyl-1,3-dioxan-2-yl)cyclohexyl]pyrimidine-5-carbonitrile Traditional Name: 2-[4-(5-amyl-1,3-dioxan-2-yl)cyclohexyl]-4-fluoro-pyrimidine-5-carbonitrile Formula: C20H28FN3O2 MolecularWeight: 361.453623

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1COC(OC1)C2CCC(CC2)C3=NC=C(C(=N3)F)C#N

Isomeric SMILES

CCCCCC1COC(OC1)C2CCC(CC2)C3=NC=C(C(=N3)F)C#N

InChI

InChI=1S/C20H28FN3O2/c1-2-3-4-5-14-12-25-20(26-13-14)16-8-6-15(7-9-16)19-23-11-17(10-22)18(21)24-19/h11,14-16,20H,2-9,12-13H2,1H3