2-[2,6-bis(fluoranyl)phenyl]-5-(3-bromophenyl)pyrimidine-4-carbonitrile

Systemtic Name: 2-[2,6-bis(fluoranyl)phenyl]-5-(3-bromophenyl)pyrimidine-4-carbonitrile Openeye Name: 5-(3-bromophenyl)-2-(2,6-difluorophenyl)pyrimidine-4-carbonitrile CAS Name: 5-(3-bromophenyl)-2-(2,6-difluorophenyl)-4-pyrimidinecarbonitrile IUPAC Name: 5-(3-bromophenyl)-2-(2,6-difluorophenyl)pyrimidine-4-carbonitrile Traditional Name: 5-(3-bromophenyl)-2-(2,6-difluorophenyl)pyrimidine-4-carbonitrile Formula: C17H8BrF2N3 MolecularWeight: 372.166326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C2=CN=C(N=C2C#N)C3=C(C=CC=C3F)F

Isomeric SMILES

C1=CC(=CC(=C1)Br)C2=CN=C(N=C2C#N)C3=C(C=CC=C3F)F

InChI

InChI=1S/C17H8BrF2N3/c18-11-4-1-3-10(7-11)12-9-22-17(23-15(12)8-21)16-13(19)5-2-6-14(16)20/h1-7,9H