3,4,5-tris(pyridin-4-ylsulfanyl)pyridine-2,6-dicarbonitrile

Systemtic Name: 3,4,5-tris(pyridin-4-ylsulfanyl)pyridine-2,6-dicarbonitrile Openeye Name: 3,4,5-tris(4-pyridylsulfanyl)pyridine-2,6-dicarbonitrile CAS Name: 3,4,5-tris(pyridin-4-ylthio)pyridine-2,6-dicarbonitrile IUPAC Name: 3,4,5-tris(pyridin-4-ylsulfanyl)pyridine-2,6-dicarbonitrile Traditional Name: 3,4,5-tris(4-pyridylthio)dipicolinonitrile Formula: C22H12N6S3 MolecularWeight: 456.56588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1SC2=C(N=C(C(=C2SC3=CC=NC=C3)SC4=CC=NC=C4)C#N)C#N

Isomeric SMILES

C1=CN=CC=C1SC2=C(N=C(C(=C2SC3=CC=NC=C3)SC4=CC=NC=C4)C#N)C#N

InChI

InChI=1S/C22H12N6S3/c23-13-18-20(29-15-1-7-25-8-2-15)22(31-17-5-11-27-12-6-17)21(19(14-24)28-18)30-16-3-9-26-10-4-16/h1-12H