2-[(3-bromophenyl)methylsulfanyl]-4-(4-fluorophenyl)-6-thiophen-2-yl-pyridine-3-carbonitrile

Systemtic Name: 2-[(3-bromophenyl)methylsulfanyl]-4-(4-fluorophenyl)-6-thiophen-2-yl-pyridine-3-carbonitrile Openeye Name: 2-[(3-bromophenyl)methylsulfanyl]-4-(4-fluorophenyl)-6-(2-thienyl)pyridine-3-carbonitrile CAS Name: 2-[(3-bromophenyl)methylthio]-4-(4-fluorophenyl)-6-thiophen-2-yl-3-pyridinecarbonitrile IUPAC Name: 2-[(3-bromophenyl)methylsulfanyl]-4-(4-fluorophenyl)-6-thiophen-2-ylpyridine-3-carbonitrile Traditional Name: 2-[(3-bromobenzyl)thio]-4-(4-fluorophenyl)-6-(2-thienyl)nicotinonitrile Formula: C23H14BrFN2S2 MolecularWeight: 481.403063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CSC2=C(C(=CC(=N2)C3=CC=CS3)C4=CC=C(C=C4)F)C#N

Isomeric SMILES

C1=CC(=CC(=C1)Br)CSC2=C(C(=CC(=N2)C3=CC=CS3)C4=CC=C(C=C4)F)C#N

InChI

InChI=1S/C23H14BrFN2S2/c24-17-4-1-3-15(11-17)14-29-23-20(13-26)19(16-6-8-18(25)9-7-16)12-21(27-23)22-5-2-10-28-22/h1-12H,14H2