5-(dimethylamino)-2-phenyl-2-(2-phenylsulfanylethyl)pentanenitrile

Systemtic Name: 5-(dimethylamino)-2-phenyl-2-(2-phenylsulfanylethyl)pentanenitrile Openeye Name: 5-(dimethylamino)-2-phenyl-2-(2-phenylsulfanylethyl)pentanenitrile CAS Name: 5-(dimethylamino)-2-phenyl-2-[2-(phenylthio)ethyl]pentanenitrile IUPAC Name: 5-(dimethylamino)-2-phenyl-2-(2-phenylsulfanylethyl)pentanenitrile Traditional Name: 5-(dimethylamino)-2-phenyl-2-[2-(phenylthio)ethyl]valeronitrile Formula: C21H26N2S MolecularWeight: 338.50954

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCC(CCSC1=CC=CC=C1)(C#N)C2=CC=CC=C2

Isomeric SMILES

CN(C)CCCC(CCSC1=CC=CC=C1)(C#N)C2=CC=CC=C2

InChI

InChI=1S/C21H26N2S/c1-23(2)16-9-14-21(18-22,19-10-5-3-6-11-19)15-17-24-20-12-7-4-8-13-20/h3-8,10-13H,9,14-17H2,1-2H3