2-[(3-bromophenyl)methylsulfanyl]-4,6-diphenyl-pyridine-3-carbonitrile

Systemtic Name: 2-[(3-bromophenyl)methylsulfanyl]-4,6-diphenyl-pyridine-3-carbonitrile Openeye Name: 2-[(3-bromophenyl)methylsulfanyl]-4,6-diphenyl-pyridine-3-carbonitrile CAS Name: 2-[(3-bromophenyl)methylthio]-4,6-diphenyl-3-pyridinecarbonitrile IUPAC Name: 2-[(3-bromophenyl)methylsulfanyl]-4,6-diphenylpyridine-3-carbonitrile Traditional Name: 2-[(3-bromobenzyl)thio]-4,6-diphenyl-nicotinonitrile Formula: C25H17BrN2S MolecularWeight: 457.38488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC3=CC(=CC=C3)Br)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC3=CC(=CC=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C25H17BrN2S/c26-21-13-7-8-18(14-21)17-29-25-23(16-27)22(19-9-3-1-4-10-19)15-24(28-25)20-11-5-2-6-12-20/h1-15H,17H2