4-(6-butylsulfanylnaphthalen-2-yl)benzenecarbonitrile

Systemtic Name: 4-(6-butylsulfanylnaphthalen-2-yl)benzenecarbonitrile Openeye Name: 4-(6-butylsulfanyl-2-naphthyl)benzonitrile CAS Name: 4-[6-(butylthio)-2-naphthalenyl]benzonitrile IUPAC Name: 4-(6-butylsulfanylnaphthalen-2-yl)benzonitrile Traditional Name: 4-[6-(butylthio)-2-naphthyl]benzonitrile Formula: C21H19NS MolecularWeight: 317.44726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC2=C(C=C1)C=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCSC1=CC2=C(C=C1)C=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H19NS/c1-2-3-12-23-21-11-10-19-13-18(8-9-20(19)14-21)17-6-4-16(15-22)5-7-17/h4-11,13-14H,2-3,12H2,1H3