3-(2,3-dihydro-1H-inden-5-ylsulfanylmethyl)benzenecarbonitrile

Systemtic Name: 3-(2,3-dihydro-1H-inden-5-ylsulfanylmethyl)benzenecarbonitrile Openeye Name: 3-(indan-5-ylsulfanylmethyl)benzonitrile CAS Name: 3-[(2,3-dihydro-1H-inden-5-ylthio)methyl]benzonitrile IUPAC Name: 3-(2,3-dihydro-1H-inden-5-ylsulfanylmethyl)benzonitrile Traditional Name: 3-[(indan-5-ylthio)methyl]benzonitrile Formula: C17H15NS MolecularWeight: 265.3727

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)SCC3=CC=CC(=C3)C#N

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)SCC3=CC=CC(=C3)C#N

InChI

InChI=1S/C17H15NS/c18-11-13-3-1-4-14(9-13)12-19-17-8-7-15-5-2-6-16(15)10-17/h1,3-4,7-10H,2,5-6,12H2