4-(2,5-dimethylphenyl)sulfanyl-3-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-(2,5-dimethylphenyl)sulfanyl-3-fluoranyl-benzenecarbonitrile Openeye Name: 4-(2,5-dimethylphenyl)sulfanyl-3-fluoro-benzonitrile CAS Name: 4-[(2,5-dimethylphenyl)thio]-3-fluorobenzonitrile IUPAC Name: 4-(2,5-dimethylphenyl)sulfanyl-3-fluorobenzonitrile Traditional Name: 4-[(2,5-dimethylphenyl)thio]-3-fluoro-benzonitrile Formula: C15H12FNS MolecularWeight: 257.325883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SC2=C(C=C(C=C2)C#N)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)SC2=C(C=C(C=C2)C#N)F

InChI

InChI=1S/C15H12FNS/c1-10-3-4-11(2)15(7-10)18-14-6-5-12(9-17)8-13(14)16/h3-8H,1-2H3