4-[(Z)-3,3-dimethyl-1-methylsulfanyl-but-1-en-2-yl]benzenecarbonitrile

Systemtic Name: 4-[(Z)-3,3-dimethyl-1-methylsulfanyl-but-1-en-2-yl]benzenecarbonitrile Openeye Name: 4-[(1Z)-2,2-dimethyl-1-(methylsulfanylmethylene)propyl]benzonitrile CAS Name: 4-[(Z)-3,3-dimethyl-1-(methylthio)but-1-en-2-yl]benzonitrile IUPAC Name: 4-[(Z)-3,3-dimethyl-1-methylsulfanylbut-1-en-2-yl]benzonitrile Traditional Name: 4-[(Z)-1-tert-butyl-2-(methylthio)vinyl]benzonitrile Formula: C14H17NS MolecularWeight: 231.35648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=CSC)C1=CC=C(C=C1)C#N

Isomeric SMILES

CC(C)(C)/C(=C/SC)/C1=CC=C(C=C1)C#N

InChI

InChI=1S/C14H17NS/c1-14(2,3)13(10-16-4)12-7-5-11(9-15)6-8-12/h5-8,10H,1-4H3/b13-10+