4-[4-(3-bromophenyl)-5-thiophen-2-yl-pyridin-2-yl]benzenecarbonitrile

Systemtic Name: 4-[4-(3-bromophenyl)-5-thiophen-2-yl-pyridin-2-yl]benzenecarbonitrile Openeye Name: 4-[4-(3-bromophenyl)-5-(2-thienyl)-2-pyridyl]benzonitrile CAS Name: 4-[4-(3-bromophenyl)-5-thiophen-2-yl-2-pyridinyl]benzonitrile IUPAC Name: 4-[4-(3-bromophenyl)-5-thiophen-2-ylpyridin-2-yl]benzonitrile Traditional Name: 4-[4-(3-bromophenyl)-5-(2-thienyl)-2-pyridyl]benzonitrile Formula: C22H13BrN2S MolecularWeight: 417.32102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C2=CC(=NC=C2C3=CC=CS3)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC(=CC(=C1)Br)C2=CC(=NC=C2C3=CC=CS3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H13BrN2S/c23-18-4-1-3-17(11-18)19-12-21(16-8-6-15(13-24)7-9-16)25-14-20(19)22-5-2-10-26-22/h1-12,14H