3-pyrimidin-2-ylsulfanylpentanenitrile

Systemtic Name: 3-pyrimidin-2-ylsulfanylpentanenitrile Openeye Name: 3-pyrimidin-2-ylsulfanylpentanenitrile CAS Name: 3-(2-pyrimidinylthio)pentanenitrile IUPAC Name: 3-pyrimidin-2-ylsulfanylpentanenitrile Traditional Name: 3-(2-pyrimidylthio)valeronitrile Formula: C9H11N3S MolecularWeight: 193.26874

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC#N)SC1=NC=CC=N1

Isomeric SMILES

CCC(CC#N)SC1=NC=CC=N1

InChI

InChI=1S/C9H11N3S/c1-2-8(4-5-10)13-9-11-6-3-7-12-9/h3,6-8H,2,4H2,1H3