3-(2,3-dihydro-1H-inden-5-ylsulfanyl)pentanenitrile

Systemtic Name: 3-(2,3-dihydro-1H-inden-5-ylsulfanyl)pentanenitrile Openeye Name: 3-indan-5-ylsulfanylpentanenitrile CAS Name: 3-(2,3-dihydro-1H-inden-5-ylthio)pentanenitrile IUPAC Name: 3-(2,3-dihydro-1H-inden-5-ylsulfanyl)pentanenitrile Traditional Name: 3-(indan-5-ylthio)valeronitrile Formula: C14H17NS MolecularWeight: 231.35648

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC#N)SC1=CC2=C(CCC2)C=C1

Isomeric SMILES

CCC(CC#N)SC1=CC2=C(CCC2)C=C1

InChI

InChI=1S/C14H17NS/c1-2-13(8-9-15)16-14-7-6-11-4-3-5-12(11)10-14/h6-7,10,13H,2-5,8H2,1H3