2-[2-(1H-imidazo[4,5-b]pyrazin-2-yl)-5-methylsulfanyl-phenoxy]ethanenitrile

Systemtic Name: 2-[2-(1H-imidazo[4,5-b]pyrazin-2-yl)-5-methylsulfanyl-phenoxy]ethanenitrile Openeye Name: 2-[2-(1H-imidazo[4,5-b]pyrazin-2-yl)-5-methylsulfanyl-phenoxy]acetonitrile CAS Name: 2-[2-(1H-imidazo[4,5-b]pyrazin-2-yl)-5-(methylthio)phenoxy]acetonitrile IUPAC Name: 2-[2-(1H-imidazo[4,5-b]pyrazin-2-yl)-5-methylsulfanylphenoxy]acetonitrile Traditional Name: 2-[2-(1H-imidazo[4,5-b]pyrazin-2-yl)-5-(methylthio)phenoxy]acetonitrile Formula: C14H11N5OS MolecularWeight: 297.33504

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C=C1)C2=NC3=NC=CN=C3N2)OCC#N

Isomeric SMILES

CSC1=CC(=C(C=C1)C2=NC3=NC=CN=C3N2)OCC#N

InChI

InChI=1S/C14H11N5OS/c1-21-9-2-3-10(11(8-9)20-7-4-15)12-18-13-14(19-12)17-6-5-16-13/h2-3,5-6,8H,7H2,1H3,(H,16,17,18,19)