2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)ethanenitrile

Systemtic Name: 2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)ethanenitrile Openeye Name: 2-(benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)acetonitrile CAS Name: 2-(4-benzofuro[3,2-d]pyrimidinylthio)acetonitrile IUPAC Name: 2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)acetonitrile Traditional Name: 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)acetonitrile Formula: C12H7N3OS MolecularWeight: 241.26848

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(O2)C(=NC=N3)SCC#N

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(O2)C(=NC=N3)SCC#N

InChI

InChI=1S/C12H7N3OS/c13-5-6-17-12-11-10(14-7-15-12)8-3-1-2-4-9(8)16-11/h1-4,7H,6H2