2-azanyl-5-(2-fluorophenyl)-4-methyl-6-methylsulfanyl-benzene-1,3-dicarbonitrile

Systemtic Name: 2-azanyl-5-(2-fluorophenyl)-4-methyl-6-methylsulfanyl-benzene-1,3-dicarbonitrile Openeye Name: 2-amino-5-(2-fluorophenyl)-4-methyl-6-methylsulfanyl-benzene-1,3-dicarbonitrile CAS Name: 2-amino-5-(2-fluorophenyl)-4-methyl-6-(methylthio)benzene-1,3-dicarbonitrile IUPAC Name: 2-amino-5-(2-fluorophenyl)-4-methyl-6-methylsulfanylbenzene-1,3-dicarbonitrile Traditional Name: 2-amino-5-(2-fluorophenyl)-4-methyl-6-(methylthio)isophthalonitrile Formula: C16H12FN3S MolecularWeight: 297.349983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C2=CC=CC=C2F)SC)C#N)N)C#N

Isomeric SMILES

CC1=C(C(=C(C(=C1C2=CC=CC=C2F)SC)C#N)N)C#N

InChI

InChI=1S/C16H12FN3S/c1-9-11(7-18)15(20)12(8-19)16(21-2)14(9)10-5-3-4-6-13(10)17/h3-6H,20H2,1-2H3