3-pyrimidin-2-ylsulfanylpropanenitrile

Systemtic Name: 3-pyrimidin-2-ylsulfanylpropanenitrile Openeye Name: 3-pyrimidin-2-ylsulfanylpropanenitrile CAS Name: 3-(2-pyrimidinylthio)propanenitrile IUPAC Name: 3-pyrimidin-2-ylsulfanylpropanenitrile Traditional Name: 3-(2-pyrimidylthio)propionitrile Formula: C7H7N3S MolecularWeight: 165.21558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SCCC#N

Isomeric SMILES

C1=CN=C(N=C1)SCCC#N

InChI

InChI=1S/C7H7N3S/c8-3-1-6-11-7-9-4-2-5-10-7/h2,4-5H,1,6H2