4-[3-(1H-benzimidazol-2-yl)pyridin-2-yl]sulfanylbutanenitrile

Systemtic Name: 4-[3-(1H-benzimidazol-2-yl)pyridin-2-yl]sulfanylbutanenitrile Openeye Name: 4-[[3-(1H-benzimidazol-2-yl)-2-pyridyl]sulfanyl]butanenitrile CAS Name: 4-[[3-(1H-benzimidazol-2-yl)-2-pyridinyl]thio]butanenitrile IUPAC Name: 4-[3-(1H-benzimidazol-2-yl)pyridin-2-yl]sulfanylbutanenitrile Traditional Name: 4-[[3-(1H-benzimidazol-2-yl)-2-pyridyl]thio]butyronitrile Formula: C16H14N4S MolecularWeight: 294.37416

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)C3=C(N=CC=C3)SCCCC#N

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)C3=C(N=CC=C3)SCCCC#N

InChI

InChI=1S/C16H14N4S/c17-9-3-4-11-21-16-12(6-5-10-18-16)15-19-13-7-1-2-8-14(13)20-15/h1-2,5-8,10H,3-4,11H2,(H,19,20)