3-fluoranyl-4-methyl-5-[1-(4-methylsulfanylphenyl)ethylamino]benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-methyl-5-[1-(4-methylsulfanylphenyl)ethylamino]benzenecarbonitrile Openeye Name: 3-fluoro-4-methyl-5-[1-(4-methylsulfanylphenyl)ethylamino]benzonitrile CAS Name: 3-fluoro-4-methyl-5-[1-[4-(methylthio)phenyl]ethylamino]benzonitrile IUPAC Name: 3-fluoro-4-methyl-5-[1-(4-methylsulfanylphenyl)ethylamino]benzonitrile Traditional Name: 3-fluoro-4-methyl-5-[1-[4-(methylthio)phenyl]ethylamino]benzonitrile Formula: C17H17FN2S MolecularWeight: 300.393683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1F)C#N)NC(C)C2=CC=C(C=C2)SC

Isomeric SMILES

CC1=C(C=C(C=C1F)C#N)NC(C)C2=CC=C(C=C2)SC

InChI

InChI=1S/C17H17FN2S/c1-11-16(18)8-13(10-19)9-17(11)20-12(2)14-4-6-15(21-3)7-5-14/h4-9,12,20H,1-3H3