3-fluoranyl-4-methyl-5-(3-methylsulfanylpropylamino)benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-methyl-5-(3-methylsulfanylpropylamino)benzenecarbonitrile Openeye Name: 3-fluoro-4-methyl-5-(3-methylsulfanylpropylamino)benzonitrile CAS Name: 3-fluoro-4-methyl-5-[3-(methylthio)propylamino]benzonitrile IUPAC Name: 3-fluoro-4-methyl-5-(3-methylsulfanylpropylamino)benzonitrile Traditional Name: 3-fluoro-4-methyl-5-[3-(methylthio)propylamino]benzonitrile Formula: C12H15FN2S MolecularWeight: 238.324303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1F)C#N)NCCCSC

Isomeric SMILES

CC1=C(C=C(C=C1F)C#N)NCCCSC

InChI

InChI=1S/C12H15FN2S/c1-9-11(13)6-10(8-14)7-12(9)15-4-3-5-16-2/h6-7,15H,3-5H2,1-2H3