2-[4-[(2-butylimidazo[4,5-b]pyridin-3-yl)methyl]phenyl]-1-benzothiophene-3-carbonitrile

Systemtic Name: 2-[4-[(2-butylimidazo[4,5-b]pyridin-3-yl)methyl]phenyl]-1-benzothiophene-3-carbonitrile Openeye Name: 2-[4-[(2-butylimidazo[4,5-b]pyridin-3-yl)methyl]phenyl]benzothiophene-3-carbonitrile CAS Name: 2-[4-[(2-butyl-3-imidazo[4,5-b]pyridinyl)methyl]phenyl]-1-benzothiophene-3-carbonitrile IUPAC Name: 2-[4-[(2-butylimidazo[4,5-b]pyridin-3-yl)methyl]phenyl]-1-benzothiophene-3-carbonitrile Traditional Name: 2-[4-[(2-butylimidazo[4,5-b]pyridin-3-yl)methyl]phenyl]benzothiophene-3-carbonitrile Formula: C26H22N4S MolecularWeight: 422.54468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=C(C5=CC=CC=C5S4)C#N)N=CC=C2

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=C(C5=CC=CC=C5S4)C#N)N=CC=C2

InChI

InChI=1S/C26H22N4S/c1-2-3-10-24-29-22-8-6-15-28-26(22)30(24)17-18-11-13-19(14-12-18)25-21(16-27)20-7-4-5-9-23(20)31-25/h4-9,11-15H,2-3,10,17H2,1H3