2-(3-chloranyl-4-fluoranyl-phenyl)-5-[4-[(E)-pent-1-enyl]cyclohexyl]pyrimidine

Systemtic Name: 2-(3-chloranyl-4-fluoranyl-phenyl)-5-[4-[(E)-pent-1-enyl]cyclohexyl]pyrimidine Openeye Name: 2-(3-chloro-4-fluoro-phenyl)-5-[4-[(E)-pent-1-enyl]cyclohexyl]pyrimidine CAS Name: 2-(3-chloro-4-fluorophenyl)-5-[4-[(E)-pent-1-enyl]cyclohexyl]pyrimidine IUPAC Name: 2-(3-chloro-4-fluorophenyl)-5-[4-[(E)-pent-1-enyl]cyclohexyl]pyrimidine Traditional Name: 2-(3-chloro-4-fluoro-phenyl)-5-[4-[(E)-pent-1-enyl]cyclohexyl]pyrimidine Formula: C21H24ClFN2 MolecularWeight: 358.880063

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Descriptors Computed from Structure

Canonical SMILES:

CCCC=CC1CCC(CC1)C2=CN=C(N=C2)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CCC/C=C/C1CCC(CC1)C2=CN=C(N=C2)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C21H24ClFN2/c1-2-3-4-5-15-6-8-16(9-7-15)18-13-24-21(25-14-18)17-10-11-20(23)19(22)12-17/h4-5,10-16H,2-3,6-9H2,1H3/b5-4+