2,4-bis(1-benzothiophen-3-yl)-3-pyridin-4-yl-pentanedinitrile

Systemtic Name: 2,4-bis(1-benzothiophen-3-yl)-3-pyridin-4-yl-pentanedinitrile Openeye Name: 2,4-bis(benzothiophen-3-yl)-3-(4-pyridyl)pentanedinitrile CAS Name: 2,4-bis(1-benzothiophen-3-yl)-3-pyridin-4-ylpentanedinitrile IUPAC Name: 2,4-bis(1-benzothiophen-3-yl)-3-pyridin-4-ylpentanedinitrile Traditional Name: 2,4-bis(benzothiophen-3-yl)-3-(4-pyridyl)glutaronitrile Formula: C26H17N3S2 MolecularWeight: 435.56328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CS2)C(C#N)C(C3=CC=NC=C3)C(C#N)C4=CSC5=CC=CC=C54

Isomeric SMILES

C1=CC=C2C(=C1)C(=CS2)C(C#N)C(C3=CC=NC=C3)C(C#N)C4=CSC5=CC=CC=C54

InChI

InChI=1S/C26H17N3S2/c27-13-20(22-15-30-24-7-3-1-5-18(22)24)26(17-9-11-29-12-10-17)21(14-28)23-16-31-25-8-4-2-6-19(23)25/h1-12,15-16,20-21,26H